ChemSpider 2D Image | 4-Bromo-N-[(1R)-1-(2,4-difluorophenyl)ethyl]-2-[(5-quinoxalinylsulfonyl)amino]benzamide | C23H17BrF2N4O3S

4-Bromo-N-[(1R)-1-(2,4-difluorophenyl)ethyl]-2-[(5-quinoxalinylsulfonyl)amino]benzamide

  • Molecular FormulaC23H17BrF2N4O3S
  • Average mass547.372 Da
  • Monoisotopic mass546.017273 Da
  • ChemSpider ID9482299

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

4-Brom-2-[(5-chinoxalinylsulfonyl)amino]-N-[(1R)-1-(2,4-difluorphenyl)ethyl]benzamid [German] [ACD/IUPAC Name]
4-Bromo-N-[(1R)-1-(2,4-difluorophenyl)ethyl]-2-[(5-quinoxalinylsulfonyl)amino]benzamide [ACD/IUPAC Name]
4-Bromo-N-[(1R)-1-(2,4-difluorophényl)éthyl]-2-[(5-quinoxalinylsulfonyl)amino]benzamide [French] [ACD/IUPAC Name]
Benzamide, 4-bromo-N-[(1R)-1-(2,4-difluorophenyl)ethyl]-2-[(5-quinoxalinylsulfonyl)amino]- [ACD/Index Name]
4-bromo-N-[(1R)-1-(2,4-difluorophenyl)ethyl]-2-(quinoxalin-5-ylsulfonylamino)benzamide
844645-08-5 [RN]
JNJ26070109
JNJ-26070109

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.667
Molar Refractivity: 127.4±0.4 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 4.68
ACD/LogD (pH 5.5): 4.42
ACD/BCF (pH 5.5): 1283.16
ACD/KOC (pH 5.5): 5526.01
ACD/LogD (pH 7.4): 3.31
ACD/BCF (pH 7.4): 99.82
ACD/KOC (pH 7.4): 429.90
Polar Surface Area: 109 Å2
Polarizability: 50.5±0.5 10-24cm3
Surface Tension: 64.9±3.0 dyne/cm
Molar Volume: 342.0±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement