ChemSpider 2D Image | (3R,3aS,6aR)-Hexahydrofuro[2,3-b]furan-3-yl [(2S,3R)-4-([(4-aminophenyl)sulfonyl]{[(4R)-2-oxo-1,3-oxazolidin-4-yl]methyl}amino)-3-hydroxy-1-phenyl-2-butanyl]carbamate | C27H34N4O9S

(3R,3aS,6aR)-Hexahydrofuro[2,3-b]furan-3-yl [(2S,3R)-4-([(4-aminophenyl)sulfonyl]{[(4R)-2-oxo-1,3-oxazolidin-4-yl]methyl}amino)-3-hydroxy-1-phenyl-2-butanyl]carbamate

  • Molecular FormulaC27H34N4O9S
  • Average mass590.645 Da
  • Monoisotopic mass590.204651 Da
  • ChemSpider ID24687056

  • defined stereocentres - 6 of 6 defined stereocentres

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

(3R,3aS,6aR)-Hexahydrofuro[2,3-b]furan-3-yl [(2S,3R)-4-([(4-aminophenyl)sulfonyl]{[(4R)-2-oxo-1,3-oxazolidin-4-yl]methyl}amino)-3-hydroxy-1-phenyl-2-butanyl]carbamate [ACD/IUPAC Name]
(3R,3aS,6aR)-Hexahydrofuro[2,3-b]furan-3-yl-[(2S,3R)-4-([(4-aminophenyl)sulfonyl]{[(4R)-2-oxo-1,3-oxazolidin-4-yl]methyl}amino)-3-hydroxy-1-phenyl-2-butanyl]carbamat [German] [ACD/IUPAC Name]
[(2S,3R)-4-([(4-Aminophényl)sulfonyl]{[(4R)-2-oxo-1,3-oxazolidin-4-yl]méthyl}amino)-3-hydroxy-1-phényl-2-butanyl]carbamate de (3R,3aS,6aR)-hexahydrofuro[2,3-b]furan-3-yle [French] [ACD/IUPAC Name]
Carbamic acid, N-[(1S,2R)-3-[[(4-aminophenyl)sulfonyl][[(4R)-2-oxo-4-oxazolidinyl]methyl]amino]-2-hydroxy-1-(phenylmethyl)propyl]-, (3R,3aS,6aR)-hexahydrofuro[2,3-b]furan-3-yl ester [ACD/Index Name]
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL447890/
oxazolidinone, 30

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.657
Molar Refractivity: 147.0±0.4 cm3
#H bond acceptors: 13
#H bond donors: 5
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 3
ACD/LogP: 2.39
ACD/LogD (pH 5.5): 1.84
ACD/BCF (pH 5.5): 14.84
ACD/KOC (pH 5.5): 239.93
ACD/LogD (pH 7.4): 1.84
ACD/BCF (pH 7.4): 14.84
ACD/KOC (pH 7.4): 239.92
Polar Surface Area: 187 Å2
Polarizability: 58.3±0.5 10-24cm3
Surface Tension: 75.2±5.0 dyne/cm
Molar Volume: 399.7±5.0 cm3

Click to predict properties on the Chemicalize site


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