ChemSpider 2D Image | N-[(1-Methyl-1H-benzimidazol-2-yl)methyl]-1-phenyl-5-(1H-pyrrol-1-yl)-1H-1,2,3-triazole-4-carboxamide | C22H19N7O

N-[(1-Methyl-1H-benzimidazol-2-yl)methyl]-1-phenyl-5-(1H-pyrrol-1-yl)-1H-1,2,3-triazole-4-carboxamide

  • Molecular FormulaC22H19N7O
  • Average mass397.433 Da
  • Monoisotopic mass397.165100 Da
  • ChemSpider ID31077929

More details:

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

1H-1,2,3-Triazole-4-carboxamide, N-[(1-methyl-1H-benzimidazol-2-yl)methyl]-1-phenyl-5-(1H-pyrrol-1-yl)- [ACD/Index Name]
N-[(1-Methyl-1H-benzimidazol-2-yl)methyl]-1-phenyl-5-(1H-pyrrol-1-yl)-1H-1,2,3-triazol-4-carboxamid [German] [ACD/IUPAC Name]
N-[(1-Methyl-1H-benzimidazol-2-yl)methyl]-1-phenyl-5-(1H-pyrrol-1-yl)-1H-1,2,3-triazole-4-carboxamide [ACD/IUPAC Name]
N-[(1-Méthyl-1H-benzimidazol-2-yl)méthyl]-1-phényl-5-(1H-pyrrol-1-yl)-1H-1,2,3-triazole-4-carboxamide [French] [ACD/IUPAC Name]
1798485-26-3 [RN]
N-((1-methyl-1H-benzo[d]imidazol-2-yl)methyl)-1-phenyl-5-(1H-pyrrol-1-yl)-1H-1,2,3-triazole-4-carboxamide
N-[(1-methyl-1H-1,3-benzodiazol-2-yl)methyl]-1-phenyl-5-(1H-pyrrol-1-yl)-1H-1,2,3-triazole-4-carboxamide

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: 1.726
Molar Refractivity: 115.9±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.22
ACD/LogD (pH 5.5): 2.18
ACD/BCF (pH 5.5): 26.07
ACD/KOC (pH 5.5): 345.27
ACD/LogD (pH 7.4): 2.24
ACD/BCF (pH 7.4): 29.90
ACD/KOC (pH 7.4): 395.91
Polar Surface Area: 83 Å2
Polarizability: 46.0±0.5 10-24cm3
Surface Tension: 59.4±7.0 dyne/cm
Molar Volume: 291.6±7.0 cm3

Click to predict properties on the Chemicalize site


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