ChemSpider 2D Image | 2-{[4-Chloro-3-(4-morpholinylsulfonyl)phenyl]amino}-2-oxoethyl 2-(butylamino)benzoate | C23H28ClN3O6S

2-{[4-Chloro-3-(4-morpholinylsulfonyl)phenyl]amino}-2-oxoethyl 2-(butylamino)benzoate

  • Molecular FormulaC23H28ClN3O6S
  • Average mass510.003 Da
  • Monoisotopic mass509.138733 Da
  • ChemSpider ID3173291

More details:

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

2-(Butylamino)benzoate de 2-{[4-chloro-3-(4-morpholinylsulfonyl)phényl]amino}-2-oxoéthyle [French] [ACD/IUPAC Name]
2-{[4-Chlor-3-(4-morpholinylsulfonyl)phenyl]amino}-2-oxoethyl-2-(butylamino)benzoat [German] [ACD/IUPAC Name]
2-{[4-Chloro-3-(4-morpholinylsulfonyl)phenyl]amino}-2-oxoethyl 2-(butylamino)benzoate [ACD/IUPAC Name]
Benzoic acid, 2-(butylamino)-, 2-[[4-chloro-3-(4-morpholinylsulfonyl)phenyl]amino]-2-oxoethyl ester [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.609
Molar Refractivity: 128.9±0.4 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 4.63
ACD/LogD (pH 5.5): 4.30
ACD/BCF (pH 5.5): 1095.82
ACD/KOC (pH 5.5): 5214.65
ACD/LogD (pH 7.4): 4.30
ACD/BCF (pH 7.4): 1097.56
ACD/KOC (pH 7.4): 5222.95
Polar Surface Area: 122 Å2
Polarizability: 51.1±0.5 10-24cm3
Surface Tension: 60.0±3.0 dyne/cm
Molar Volume: 372.1±3.0 cm3

Click to predict properties on the Chemicalize site


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