ChemSpider 2D Image | 3-(1H-Benzimidazol-2-yl)-N-{[7-(trifluoromethyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyridin-3-yl]methyl}propanamide | C18H19F3N6O

3-(1H-Benzimidazol-2-yl)-N-{[7-(trifluoromethyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyridin-3-yl]methyl}propanamide

  • Molecular FormulaC18H19F3N6O
  • Average mass392.378 Da
  • Monoisotopic mass392.157257 Da
  • ChemSpider ID57827978

More details:






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

1H-Benzimidazole-2-propanamide, N-[[5,6,7,8-tetrahydro-7-(trifluoromethyl)-1,2,4-triazolo[4,3-a]pyridin-3-yl]methyl]- [ACD/Index Name]
3-(1H-Benzimidazol-2-yl)-N-{[7-(trifluormethyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyridin-3-yl]methyl}propanamid [German] [ACD/IUPAC Name]
3-(1H-Benzimidazol-2-yl)-N-{[7-(trifluoromethyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyridin-3-yl]methyl}propanamide [ACD/IUPAC Name]
3-(1H-Benzimidazol-2-yl)-N-{[7-(trifluorométhyl)-5,6,7,8-tétrahydro[1,2,4]triazolo[4,3-a]pyridin-3-yl]méthyl}propanamide [French] [ACD/IUPAC Name]
3-(1H-benzo[d]imidazol-2-yl)-N-((7-(trifluoromethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methyl)propanamide

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.676
Molar Refractivity: 95.5±0.5 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.02
ACD/LogD (pH 5.5): 1.08
ACD/BCF (pH 5.5): 3.07
ACD/KOC (pH 5.5): 59.14
ACD/LogD (pH 7.4): 1.49
ACD/BCF (pH 7.4): 7.89
ACD/KOC (pH 7.4): 151.81
Polar Surface Area: 88 Å2
Polarizability: 37.9±0.5 10-24cm3
Surface Tension: 52.7±7.0 dyne/cm
Molar Volume: 253.9±7.0 cm3

Click to predict properties on the Chemicalize site






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