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GB2078725A - N-chlorocarbonyl Lactams - Google Patents

N-chlorocarbonyl Lactams Download PDF

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Publication number
GB2078725A
GB2078725A GB8114762A GB8114762A GB2078725A GB 2078725 A GB2078725 A GB 2078725A GB 8114762 A GB8114762 A GB 8114762A GB 8114762 A GB8114762 A GB 8114762A GB 2078725 A GB2078725 A GB 2078725A
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group
chlorocarbonyl
reaction
toluene
triethylamine
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GB8114762A
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GB2078725B (en
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Pliva Farmaceutika dd
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Pliva Farmaceutska Kemijska Prehrambena I Kozmeticka Industrija dd
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    • CCHEMISTRY; METALLURGY
    • C07ORGANIC CHEMISTRY
    • C07DHETEROCYCLIC COMPOUNDS
    • C07D207/00Heterocyclic compounds containing five-membered rings not condensed with other rings, with one nitrogen atom as the only ring hetero atom
    • C07D207/02Heterocyclic compounds containing five-membered rings not condensed with other rings, with one nitrogen atom as the only ring hetero atom with only hydrogen or carbon atoms directly attached to the ring nitrogen atom
    • C07D207/18Heterocyclic compounds containing five-membered rings not condensed with other rings, with one nitrogen atom as the only ring hetero atom with only hydrogen or carbon atoms directly attached to the ring nitrogen atom having one double bond between ring members or between a ring member and a non-ring member
    • C07D207/22Heterocyclic compounds containing five-membered rings not condensed with other rings, with one nitrogen atom as the only ring hetero atom with only hydrogen or carbon atoms directly attached to the ring nitrogen atom having one double bond between ring members or between a ring member and a non-ring member with hetero atoms or with carbon atoms having three bonds to hetero atoms with at the most one bond to halogen, e.g. ester or nitrile radicals, directly attached to ring carbon atoms
    • C07D207/24Oxygen or sulfur atoms
    • C07D207/262-Pyrrolidones
    • C07D207/2632-Pyrrolidones with only hydrogen atoms or radicals containing only hydrogen and carbon atoms directly attached to other ring carbon atoms
    • C07D207/272-Pyrrolidones with only hydrogen atoms or radicals containing only hydrogen and carbon atoms directly attached to other ring carbon atoms with substituted hydrocarbon radicals directly attached to the ring nitrogen atom
    • CCHEMISTRY; METALLURGY
    • C07ORGANIC CHEMISTRY
    • C07DHETEROCYCLIC COMPOUNDS
    • C07D225/00Heterocyclic compounds containing rings of more than seven members having one nitrogen atom as the only ring hetero atom
    • C07D225/02Heterocyclic compounds containing rings of more than seven members having one nitrogen atom as the only ring hetero atom not condensed with other rings
    • CCHEMISTRY; METALLURGY
    • C07ORGANIC CHEMISTRY
    • C07DHETEROCYCLIC COMPOUNDS
    • C07D513/00Heterocyclic compounds containing in the condensed system at least one hetero ring having nitrogen and sulfur atoms as the only ring hetero atoms, not provided for in groups C07D463/00, C07D477/00 or C07D499/00 - C07D507/00
    • C07D513/02Heterocyclic compounds containing in the condensed system at least one hetero ring having nitrogen and sulfur atoms as the only ring hetero atoms, not provided for in groups C07D463/00, C07D477/00 or C07D499/00 - C07D507/00 in which the condensed system contains two hetero rings
    • C07D513/08Bridged systems

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  • Chemical & Material Sciences (AREA)
  • Organic Chemistry (AREA)

Abstract

N-chlorocarbonyl lactams are made by reacting the corresponding heterocyclic lactam, or a trimethylsilyl derivative or a sodium salt, with carbonyl dichloride. Products can thus be made of the formula: <IMAGE> wherein X is C1-6 alkylene, C1-5 aliphatic with N, O or S as a heteroatom, cycloalkyl up to C6, aryl or aralkyl with up to C5 in the alkyl moiety or <IMAGE> where Y is a C1-5 group or a C0-4 group with N, O or S as a heteroatom and n is 0-3.

Description

SPECIFICATION N-chlorocarbonyl Lactams This invention relates to the manufacture of N-chlorocarbonyl lactams of the general formula:
wherein X is a C16 alkyiene group, a C15 aliphatic group comprising a heteroatom selected from N, O and S, a cycloalkyl group having up to 6 carbon atoms, an aryl or aralkyl group having up to 5 carbon atoms in the alkyl moiety or a group of the formula
wherein Y represents a C15 group or a C,, group comprising a heteroatom selected from N, 0 and S and n represents an integer from 0 to 3.
Some less complex N-chlorocarbonyl lactams of formula I are known compounds and are used in the preparation of ureidopenicillins (DE-OS 2025414).
We have now found that compounds of formula I may be generally used in the preparation of mixed anhydrides, which are important intermediates in the synthesis of semi-synthetic penicillins. Of special interest is the hitherto unknown N3-chlorocarbonyl-N8-acetyl-7 ,7-dimethyl-6-thia-3 8-diaza bicyclo[3,2,1]octan-2-one, owing to the possibility of regeneration of N6-acetyl-7,7-dimethyl-6-thia- 3,8-diazabicyclo[3,2,1 ]octan-2-one and its reconversion to the corresponding N3-chlorocarbonyl derivative.
It is known that certain less complex N-chlorocarbonyl lactams may be prepared by the hydrolysis of 1 -aza-2-methoxy-cycloalk-2-ene-1-carbonyl chlorides (DE-OS 1939236), which in turn are obtainable by the reaction of l-aza-2-methoxy- 1 -aza-2-methoxy-cycloalk-2-enes with carbonyl di chloride in the presence of triethylamine [G. Falkenstein and H. Doerfel, Makromol. Chem. 1969 (127) 34]. The preparation of N-chlorocarbonyl caprolactam by the action of CH3Li and then carbonyl chloride on caprolactam has also been described (DE-OS 2025414).
The preparation of simple N-chlorocarbonyl derivatives of sec.amides has also been described, by means of the reaction of the corresponding N-trimethylsilyl derivatives of sec.amides with carbonyl dichloride; in this way, N-chlorocarbonyl N-methyl-acetamide and N-methyl-benzamide were obtained [V. F. Mironov, V. D. Seludiakov, V. P. Koziukov, Zur. Obscei Him. 39 (1 969) 220].
It has now been found that complex or non-compiex N-chlorocarbonyl lactams of formula I can be obtained, if a lactam of the general formula:
wherein X has the above-defined meaning, or a trimethylsilyl derivative or a sodium salt thereof, is reacted with carbonyl dichloride.
The reaction is preferably carried out in an appropriate inert organic solvent, preferably methylene chloride or toluene, and most suitably at a temperature of about OOC. Optionally, the reaction may be conducted in the presence of a tertiary organic base, e.g. triethylamine, as an acid-binding agent. The reaction time may typically range from 30 to 1 20 minutes, under stirring.
The trimethylsilyl derivative of the lactam II is obtained in a conventional manner by silylation with trimethylsilyl chloride in an inert organic solvent, preferably methylene chloride ortoluene, at a temperature within the range from about 200C to the boiling point of the reaction mixture. The reaction is suitably carried out in the presence of a tertiary organic base, e.g. triethylamine, as an acidbinding agent.
Conversion of the lactam Il to its sodium salt is effected in a conventional manner as well, preferably by the action of metallic sodium on the lactam.
The reactants are convenientiy employed in stoichiometric quantities or a slight excess of the silylation agent, the tertiary base or carbonyl dichloride with respect to the lactam may be used.
The resulting product I is isolated from the reaction mixture and purified in conventional manner, e.g. by the addition of water to the reaction mixture, followed by an immediate separation of the layers, drying of the organic layer and evaporation of the solvent. Alternatively, the precipitated triethylamine hydrochloride is filtered off, the solvent is evaporated from the reaction solution and the residue is purified by distillation or, provided the product is a solid, by washing the solid residue with a suitable solvent.
The invention is illustrated but in no way limited by the following Examples.
Example 1 N-Chlorocarbonyl-pyrrolidin-2-one a) Pyrrolidin-2-one (8.5 g, 0.1 mole) and triethylamine (10.1 g, 0.1 mole) were added to toluene (100 ml) and, while stirring and under a continuous stream of nitrogen at 250C, trimethyl-chlorosilane (10.86 g, 0.1 mole) was added. The reaction mixture was stirred at 400C for 30 minutes, whereupon it was cooled to 0 C. The triethylamine hydrochloride which precipitated was aspirated and the mother liquor was mixed at OOC with stirring, for 30 minutes, with a 20% w/w solution of carbonyl chloride in toluene (52 ml). The reaction mixture was then stirred for 1 hour, whereupon the solvent was evaporated, leaving an oily residue. The residue was distilled at a b.p. of 11 2a1 1 60C and 0.13 Pa.
Yield: 10.5 g (71.2%) of a colourless oil.
Analysis: QH6NO2Cl (147.56) Cain.: C 40.69 H 4.10 N 9.49 Cl 24.03 Found: C 40.55 H 4.43 N 9.71 Cl 25.20 IR spectrum (film): 1810 (vs), 1764 (m), 1720 (s), 1350 (m), 1265 (s), 1227 (m), 1170 (s), 1095 (m), 885 (w) cm-11H NMR (CDCI3)a: 1.78-2.90 (m, CH,--CH,,-CO), 3.654.35 (m, CH2N).
b) Trimethyl-chlorosilane (10.86 g, 0.1 mole) was added at a temperature of 25"C, with stirring, to a solution of pyrrolidin-2-one (8.5 g, 0.1 mole) triethylamine (10.1 g, 0.1 mole) and methylene chloride (100 ml). The reaction mixture was stirred for 1 hour at a temperature of 400C, whereupon it was cooled to OOC and carbonyl dichloride (lOg, 0.11 mole) was added over 30 to 40 minutes. The reaction mixture was stirred for 1 hour and subsequently mixed with water (60 ml), while the temperature was kept at 0 to +50C for 5 minutes, with stirring. The organic layer was separated, dried and worked up as indicated under a).
Yield: 1 3 g (88.2%) of an oily product showing the same characteristics as the product described in a).
c) A solution of pyrrolidin-2-one (8.5 g, 0.1 mole) in toluene (20 ml) was added over 30 minutes to molten sodium (2.3 g, 0.1 mole) in toluene (120 ml), kept at 1 100C. The reaction mixture was stirred for 1 hour, whereupon it was cooled to OOC and, over 30 minutes, a 20% w/w solution of carbon dichloride in toluene (52 ml) was added dropwise. The reaction mixture was stirred for another 1 hour at OOC, the sodium chloride which precipitated was filtered off and the mother liquor was evaporated to yield an oily residue, which was worked up as in a).
Yield: 9.7 g (66%) of an oily product, showing the same characteristics as the product described in a).
d) A solution of pyrrolidin-2-one (8.5 g, 0.1 mole) triethylamine (10.1 g, 0.1 mole) and toluene (80 ml) was cooled to OOC, whereupon a 20% w/w solution of carbonyl chloride in toluene (52 ml) was added at a temperature of OOC over a period of 30 minutes, with stirring. The reaction mixture was stirred for 1 hour and subsequently the precipitated triethylamine hydrochloride was aspirated and the mother liquor was evaporated, yielding an oily residue.
Yield: 11.8 g (80%) of an oily residue, showing the same characteristics as in a).
e) A solution of pyrrolidin-2-one (8.5 g, 0.1 mole), triethylamine (10.1 g, 0.1 mole) and methylene chloride (100 ml) was cooled to OOC, whereupon carbonyl chloride (lOg, 0.11 mole) was added over 1 5 to 20 minutes. The reaction mixture was stirred for 2 hours at OOC, whereupon water (50 ml) was added. The organic layer was separated, dried and evaporated, yielding an oily residue, which was purified as in a).
Yield: 12.3 g (83%) of an oily product, showing the same characteristics as the product described in a).
Example 2 NChlorocarbonyl Enantholactam Trimethyl-chlorosilane (3.2 ml, 25 mmole) was added with stirring at 250C to a solution of enantholactam (3.17 g, 25 mmole), triethylamine (2.53 g, 25 mmole) and toluene (30 ml), whereupon the reaction mixture was stirred for a further 2 hours at a temperature of 500 C. The solution was cooled to OOC and subsequently a 20% w/w solution of carbonyl chloride in toluene (13 ml) was added over 30 minutes. The reaction mixture was stirred for 1 hour at OOC and the precipitated triethylamine hydrochloride was then aspirated. The mother liquor was evaporated, yielding an oily residue.
Yield: 4.14 9 (87.4%); b.p. 103 105 C/O. 13 Pa (dec.) IR spectrum (CH2CI2): 1787 (s), 1715 (vs) cam~' Example 3 3-Chlorocarbonyl-8-acetyl-7,7-dimethyl-6-thia-3,8-diazabicyclo[3,2,1]octan-2-one a)Triethylamine (1.01 g, 10 mmole) and trimethyl-chlorosilane (1.086 g, 10 mmole) were added to a suspension of 8-acetyl-7,7-dimethyl-6-thia-3,8-diazabicyclo[3,2, 1 ]octan-2-one (2.14 g, 10 mmole) in dry toluene (30 ml).The reaction mixture was stirred for 3 hours at 500 C, subsequently cooled to OOC and a 20% w/w solution of carbonyl chloride in toluene (5.2 ml) was added dropwise over 1 5 minutes and the stirring continued for 3 hours. The precipitated crystalline triethylamine hydrochloride was aspirated, whereas the mother liquor was evaporated to dryness. The residue is suspended in cold ether (5 ml) and filtered.
Yield: 2.35 g (85%) of a product with a m.p. of 1050-1070C.
IR spectrum (CH2Cl2): 1800 (s), 1730(s), 1660 (vs), 1400(s), 1290(s), 1200 (vs), 1160(s), 1110 (m) cm~'.
1H NMR (CDCI3)a: 1.46; 1.68 and 1.53; 1.68 [4 S, 2 C(CH3)2], 2.22; 2.30 (2 S, COCH3); 3.70- 4.30 (m, C4H2), 4.43; 5.08 (2 S, C,H), 5.70; 6.20 (2m, C5H).
b) Triethylamine (1.01 g, 10 mmole) and trimethylchlorosilane (1.08 g, 10 mmole) were added to a suspension of 8-acetyl-7,7-dimethyl-6-thia-3,8-diazabicyclo-[3,2,1]octan-2-one (2.14 g, 10 mmole) in dry methylene chloride (20 ml). The reaction mixture was stirred for 1 hour at the boiling point of the solution, whereupon it was cooled to OOC and, over a period of 15 minutes, a 20% w/w solution of carbonyl dichloride in toluene (5.2 ml) was added dropwise. Cold water (20 ml) was added to the reaction mixture, the resultant layers were separated and the organic layer was washed with water (2x20 ml). After drying, the solvent was evaporated, yielding a dry residue, to which ether (5 ml) was added and the resultant crystalline precipitate was aspirated.
Yield: 2.12 g (76.8%) of product, showing the same characteristics as in a).
c) Triethylamine (1.01 g, 10 mmole) was added to a suspension of 8-acetyl-7,7-dimethyl-6-thia 3,8-diazabicyclo[3,2,1]octan-2-one (2.14 g, 10 mmole) in dry toluene (30 ml), the mixture was cooled to OOC. A 20% w/w solution of carbonyl dichloride in toluene (5.5 ml) was added to the reaction mixture and it was stirred for 3 hours at the aforesaid temperature. After the addition of cold water, the organic layer was separated, washed with water and worked up as in a).
Yield: 2.30 g (83%) of the product, showing the same characteristics as in a).
d) Triethylamine (1.01 g, 10 mmole) was added to a suspension of 8-acetyl-7,7-dimethyl-6-thia3,8-diazabicyclo[3,2,1]octan-2-one (2.14 g, 10 mmole) in dry methylene chloride (20 ml) and the mixture was cooled to OOC. A 20% w/w solution of carbonyl dichloride in toluene (5.5 ml) was added to the reaction mixture dropwise over 30 minutes and the mixture was stirred for 3 hours. After the addition of water and working up as in a), a product was obtained having the same characteristics as in a).
Yield: 2.9 g (79%).

Claims (8)

Claims
1. A process of manufacture of an N-chlorocarbonyl lactam of the general formula:
wherein X is a C18 alkylene group, a C, < aliphatic group comprising a heteroatom selected from N, O and S, a cycloalkyl group having up to 6 carbon atoms, an aryl or aralkyl group having up to 5 carbon atoms in the alkyl moiety or a group of the formula
wherein Y represents a C15 group or a C,, group comprising a heteroatom selected from N, 0 and S and n represents an integer from 0 to 3, which comprises reacting a lactam of the general formula:
wherein X has the above-defined meaning, or a trimethylsilyl derivative or a sodium salt thereof, with carbonyl dichloride.
2. A process as claimed in claim 1, wherein the reaction is carried out at about 0 C.
3. A process as claimed in claim 1 or 2, wherein the reaction is carried out in an inert organic solvent.
4. A process as claimed in claim 3, wherein the solvent is methylene chloride or toluene.
5. A process as claimed in any preceding claim, wherein the reaction is carried out in the presence of a tertiary organic base.
6. A process as claimed in claim 5, wherein the base is triethylamine.
7. A process as claimed in claim 1, substantially as described in any of the foregoing Examples.
8. An N-chlorocarbonyl lactam of formula I, when manufactured by a process as claimed in any preceding claim.
GB8114762A 1980-05-24 1981-05-14 N-chlorocarbonyl lactams Expired GB2078725B (en)

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YU141080A YU141080A (en) 1980-05-24 1980-05-24 Process for preparing n-chlorocarbonl-lactams

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GB2078725A true GB2078725A (en) 1982-01-13
GB2078725B GB2078725B (en) 1984-04-18

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Cited By (7)

* Cited by examiner, † Cited by third party
Publication number Priority date Publication date Assignee Title
US4755535A (en) * 1986-04-23 1988-07-05 Nelson Research & Development Co. Compositions comprising 1-substituted azacycloalkenes
US4801586A (en) * 1986-04-23 1989-01-31 Nelson Research & Development Co. Penetration enhancers for transdermal delivery of systemic agents
US4879275A (en) * 1987-09-30 1989-11-07 Nelson Research & Development Co. Penetration enhancers for transdermal delivery of systemic agent
US4886783A (en) * 1986-01-31 1989-12-12 Nelson Research & Development Co. Penetration enhancers for transdermal delivery of systemic agents
US4920101A (en) * 1987-09-30 1990-04-24 Nelson Research & Development Co. Compositions comprising 1-oxo- or thiohydrocarbyl substituted azacycloaklkanes
US5034386A (en) * 1986-01-31 1991-07-23 Whitby Research, Inc. Methods for administration using 1-substituted azacycloalkanes
US5204339A (en) * 1986-01-31 1993-04-20 Whitby Research, Inc. Penetration enhancers for transdermal delivery of systemic agents

Families Citing this family (1)

* Cited by examiner, † Cited by third party
Publication number Priority date Publication date Assignee Title
USD605700S1 (en) * 2008-04-22 2009-12-08 Beifa Group Co., Ltd. Pen

Cited By (7)

* Cited by examiner, † Cited by third party
Publication number Priority date Publication date Assignee Title
US4886783A (en) * 1986-01-31 1989-12-12 Nelson Research & Development Co. Penetration enhancers for transdermal delivery of systemic agents
US5034386A (en) * 1986-01-31 1991-07-23 Whitby Research, Inc. Methods for administration using 1-substituted azacycloalkanes
US5204339A (en) * 1986-01-31 1993-04-20 Whitby Research, Inc. Penetration enhancers for transdermal delivery of systemic agents
US4755535A (en) * 1986-04-23 1988-07-05 Nelson Research & Development Co. Compositions comprising 1-substituted azacycloalkenes
US4801586A (en) * 1986-04-23 1989-01-31 Nelson Research & Development Co. Penetration enhancers for transdermal delivery of systemic agents
US4879275A (en) * 1987-09-30 1989-11-07 Nelson Research & Development Co. Penetration enhancers for transdermal delivery of systemic agent
US4920101A (en) * 1987-09-30 1990-04-24 Nelson Research & Development Co. Compositions comprising 1-oxo- or thiohydrocarbyl substituted azacycloaklkanes

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AT374788B (en) 1984-05-25
DE3120451A1 (en) 1982-02-04
CH649992A5 (en) 1985-06-28
ATA230881A (en) 1983-10-15
GB2078725B (en) 1984-04-18
YU141080A (en) 1983-04-30

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