ChemSpider 2D Image | 2-{4-[(4-Acetamido-4'-chloro-2-biphenylyl)methoxy]phenyl}-1-cyclohexyl-1H-benzimidazole-5-carboxylic acid | C35H32ClN3O4

2-{4-[(4-Acetamido-4'-chloro-2-biphenylyl)methoxy]phenyl}-1-cyclohexyl-1H-benzimidazole-5-carboxylic acid

  • Molecular FormulaC35H32ClN3O4
  • Average mass594.099 Da
  • Monoisotopic mass593.208130 Da
  • ChemSpider ID8364273

More details:

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

1H-Benzimidazole-5-carboxylic acid, 2-[4-[[4-(acetylamino)-4'-chloro[1,1'-biphenyl]-2-yl]methoxy]phenyl]-1-cyclohexyl- [ACD/Index Name]
2-(4-{[4-(acetylamino)-4'-chlorobiphenyl-2-yl]methoxy}phenyl)-1-cyclohexyl-1H-benzimidazole-5-carboxylic acid
2-{4-[(4-Acetamido-4'-chlor-2-biphenylyl)methoxy]phenyl}-1-cyclohexyl-1H-benzimidazol-5-carbonsäure [German] [ACD/IUPAC Name]
2-{4-[(4-Acetamido-4'-chloro-2-biphenylyl)methoxy]phenyl}-1-cyclohexyl-1H-benzimidazole-5-carboxylic acid [ACD/IUPAC Name]
Acide 2-{4-[(4-acétamido-4'-chloro-2-biphénylyl)méthoxy]phényl}-1-cyclohexyl-1H-benzimidazole-5-carboxylique [French] [ACD/IUPAC Name]
2-[4-(4-acetylamino-4'-chlorobiphenyl-2-ylmethoxy)phenyl]-1-cyclohexyl-1H-benzimidazole-5-carboxylic acid
CHEMBL379931

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.663
Molar Refractivity: 167.0±0.5 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 8.94
ACD/LogD (pH 5.5): 5.37
ACD/BCF (pH 5.5): 2552.80
ACD/KOC (pH 5.5): 2861.36
ACD/LogD (pH 7.4): 4.22
ACD/BCF (pH 7.4): 180.70
ACD/KOC (pH 7.4): 202.54
Polar Surface Area: 93 Å2
Polarizability: 66.2±0.5 10-24cm3
Surface Tension: 51.6±7.0 dyne/cm
Molar Volume: 450.9±7.0 cm3

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