ChemSpider 2D Image | 4-{6-(4-Cyano-2-methoxyphenoxy)-4-[(3,3,3-trifluoropropyl)amino]-1H-benzimidazol-1-yl}-N-cyclopropyl-2-methylbenzamide | C29H26F3N5O3

4-{6-(4-Cyano-2-methoxyphenoxy)-4-[(3,3,3-trifluoropropyl)amino]-1H-benzimidazol-1-yl}-N-cyclopropyl-2-methylbenzamide

  • Molecular FormulaC29H26F3N5O3
  • Average mass549.544 Da
  • Monoisotopic mass549.198792 Da
  • ChemSpider ID61730126

More details:

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

4-{6-(4-Cyan-2-methoxyphenoxy)-4-[(3,3,3-trifluorpropyl)amino]-1H-benzimidazol-1-yl}-N-cyclopropyl-2-methylbenzamid [German] [ACD/IUPAC Name]
4-{6-(4-Cyano-2-methoxyphenoxy)-4-[(3,3,3-trifluoropropyl)amino]-1H-benzimidazol-1-yl}-N-cyclopropyl-2-methylbenzamide [ACD/IUPAC Name]
4-{6-(4-Cyano-2-méthoxyphénoxy)-4-[(3,3,3-trifluoropropyl)amino]-1H-benzimidazol-1-yl}-N-cyclopropyl-2-méthylbenzamide [French] [ACD/IUPAC Name]
Benzamide, 4-[6-(4-cyano-2-methoxyphenoxy)-4-[(3,3,3-trifluoropropyl)amino]-1H-benzimidazol-1-yl]-N-cyclopropyl-2-methyl- [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: 1.627
Molar Refractivity: 141.9±0.5 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 3.96
ACD/LogD (pH 5.5): 4.22
ACD/BCF (pH 5.5): 938.45
ACD/KOC (pH 5.5): 4623.99
ACD/LogD (pH 7.4): 4.23
ACD/BCF (pH 7.4): 970.79
ACD/KOC (pH 7.4): 4783.34
Polar Surface Area: 101 Å2
Polarizability: 56.3±0.5 10-24cm3
Surface Tension: 46.4±7.0 dyne/cm
Molar Volume: 400.4±7.0 cm3

Click to predict properties on the Chemicalize site


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