3-{[(2S,5R,6R)-2-Carboxy-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3 .2.0]hept-6-yl]carbamoyl}-2-quinoxalinecarboxylic acid

Modify Date: 2025-08-24 19:26:38

3-{[(2S,5R,6R)-2-Carboxy-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3 .2.0]hept-6-yl]carbamoyl}-2-quinoxalinecarboxylic acid Structure
3-{[(2S,5R,6R)-2-Carboxy-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3 .2.0]hept-6-yl]carbamoyl}-2-quinoxalinecarboxylic acid structure
Common Name 3-{[(2S,5R,6R)-2-Carboxy-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3 .2.0]hept-6-yl]carbamoyl}-2-quinoxalinecarboxylic acid
CAS Number 1596-63-0 Molecular Weight 416.40800
Density 1.68g/cm3 Boiling Point 781.4ºC at 760mmHg
Molecular Formula C18H16N4O6S Melting Point N/A
MSDS N/A Flash Point 426.4ºC

 Names

Name 3-{[(2S,5R,6R)-2-Carboxy-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3 .2.0]hept-6-yl]carbamoyl}-2-quinoxalinecarboxylic acid
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.68g/cm3
Boiling Point 781.4ºC at 760mmHg
Molecular Formula C18H16N4O6S
Molecular Weight 416.40800
Flash Point 426.4ºC
Exact Mass 416.07900
PSA 178.58000
LogP 1.08600
Vapour Pressure 1.03E-25mmHg at 25°C
Index of Refraction 1.752
InChIKey GPMSLJIYNWBYEL-TYNCELHUSA-N
SMILES CC1(C)SC2C(NC(=O)c3nc4ccccc4nc3C(=O)O)C(=O)N2C1C(=O)O

 Synonyms

Quinethazon
Quinethazonum
7-Chlor-6-sulfamoyl-2-aethyl-4-oxo-1,2,3,4-tetrahydro-chinazolin
(3-carboxy-quinoxalin-2-yl)-penicillin
7-chloro-2-ethyl-4-oxo-1,2,3,4-tetrahydro-quinazoline-6-sulfonic acid amide
chinacillin
Chinethazonum
Quinacillin
Aquamox
Idrokin
Quinetazona [INN-Spanish]
7-Chlor-2-aethyl-6-sulfamoyl-1,2,3,4-tetrahydro-4-chinazolinon
Chinetazone [DCIT]
7-chloro-2-ethyl-1,2,3,4-tetrahydro-4-oxo-6-quinazolinesulfonamide
Hydromox
QUINETHAZONE
Quimethazin
Quinetazona
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