Basic information
- CAS
76788-83-5- Standard SMILES
Cc1onc(-c2ccccc2Cl)c1C(=O)N[C@@H]1C(=O)N2[C@@H](C(=O)O)C(C)(C)S(=O)(=O)[C@H]12- InChIKey
NVNVYZJTNPZRPA-JKIFEVAISA-N- Molecular formula
- C19H18ClN3O7S
- Average molar mass
- 467.9 g/mol
- Monoisotopic mass
- 467.0553988
Overview
structure given in first source
Names & identifiers
- Preferred name
- 4-Thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid, 6-(((3-(2-chlorophenyl)-5-methyl-4-isoxazolyl)carbonyl)amino)-3,3-dimethyl-7-oxo-, 4,4-dioxide, (2S-(2alpha,5alpha,6beta))-
- IUPAC
- (2S,5R,6R)-6-[[3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino]-3,3-dimethyl-4,4,7-trioxo-4λ6-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
- English name
- cloxacillin sulfone
- Molecular formula
- C19H18ClN3O7S
- Molecular weight
- 467.88012
Names & synonyms
Cloxacillin sulfone76788-83-5DTXSID202275956-(3-(2-Chlorophenyl)-5-methyl-4-isoxazolyl)penicillin sulfone4-Thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid, 6-(((3-(2-chlorophenyl)-5-methyl-4-isoxazolyl)carbonyl)amino)-3,3-dimethyl-7-oxo-, 4,4-dioxide, (2S-(2alpha,5alpha,6beta))-RefChem:127135DTXCID70150086Cloxacillin Impurity 8SCHEMBL1477662(2S,5R,6R)-6-[[3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino]-3,3-dimethyl-4,4,7-trioxo-4lambda6-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid(2S,5R,6R)-6-[3-(2-Chlorophenyl)-5-methyl-1,2-oxazole-4-carboxamido]-3,3-dimethyl-4,4,7-trioxo-4lambda~6~-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acidCloxacillin Impurity 6
Show more names
Cloxacillin Impurity 226α-[3-(2-Chlorophenyl)-5-methyl-4-isoxazolyl]penicillanic acid 4,4-dioxidesodium salt
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 155 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 4
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 905
Chemistry & industry
Applications
DescriptionCloxacillin sulfone is an antibiotic useful for the treatment of a number of bacterial infections. It is semisynthetic and in the same class as penicillin. Cloxacillin is used against staphylococci that produce beta-lactamase, due to its large R chain, which does not allow the beta-lactamases to bind. This drug has a weaker antibacterial activity than benzylpenicillin, and is devoid of serious toxicity except for allergic reactions. Cloxacillin was discovered and developed by Beecham. It is sold under a number of trade names, including Cloxapen, Cloxacap, Tegopen and Orbenin. It is on the World Health Organization's List of Essential Medicines, the most important medication needed in a basic health system.
Suppliers5 total
湖北瑞玛标物科技有限公司15787879035 15787875101 · [email protected]
南京望知星医药科技有限公司18569809817 · [email protected]
Sinco Pharmachem (ShenZhen) R&D Co., Ltd.+86-18603013401 · [email protected]
湖北扬信医药科技有限公司15374522761 · [email protected]
广州奥司汀生物技术有限公司15918640830 13268843209 · [email protected]
Related reactions
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Compound notes
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