ChemSpider 2D Image | 1-[(3,5-Difluoro-2-pyridinyl)methyl]-N-[(1R)-1-phenylpropyl]-1H-benzimidazole-5-carboxamide | C23H20F2N4O

1-[(3,5-Difluoro-2-pyridinyl)methyl]-N-[(1R)-1-phenylpropyl]-1H-benzimidazole-5-carboxamide

  • Molecular FormulaC23H20F2N4O
  • Average mass406.428 Da
  • Monoisotopic mass406.160522 Da
  • ChemSpider ID26618506
  • defined stereocentres - 1 of 1 defined stereocentres


More details:






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

1-[(3,5-Difluor-2-pyridinyl)methyl]-N-[(1R)-1-phenylpropyl]-1H-benzimidazol-5-carboxamid [German] [ACD/IUPAC Name]
1-[(3,5-Difluoro-2-pyridinyl)methyl]-N-[(1R)-1-phenylpropyl]-1H-benzimidazole-5-carboxamide [ACD/IUPAC Name]
1-[(3,5-Difluoro-2-pyridinyl)méthyl]-N-[(1R)-1-phénylpropyl]-1H-benzimidazole-5-carboxamide [French] [ACD/IUPAC Name]
1H-Benzimidazole-5-carboxamide, 1-[(3,5-difluoro-2-pyridinyl)methyl]-N-[(1R)-1-phenylpropyl]- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.627
Molar Refractivity: 111.9±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.48
ACD/LogD (pH 5.5): 3.12
ACD/BCF (pH 5.5): 138.88
ACD/KOC (pH 5.5): 1185.24
ACD/LogD (pH 7.4): 3.13
ACD/BCF (pH 7.4): 140.57
ACD/KOC (pH 7.4): 1199.66
Polar Surface Area: 60 Å2
Polarizability: 44.4±0.5 10-24cm3
Surface Tension: 44.4±7.0 dyne/cm
Molar Volume: 315.7±7.0 cm3

Click to predict properties on the Chemicalize site






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