ChemSpider 2D Image | N-[1-(2,2-Difluoroethyl)-4-piperidinyl]-1-(4-fluorophenyl)-5-(trifluoromethyl)-1H-1,2,3-triazole-4-carboxamide | C17H17F6N5O

N-[1-(2,2-Difluoroethyl)-4-piperidinyl]-1-(4-fluorophenyl)-5-(trifluoromethyl)-1H-1,2,3-triazole-4-carboxamide

  • Molecular FormulaC17H17F6N5O
  • Average mass421.340 Da
  • Monoisotopic mass421.133728 Da
  • ChemSpider ID34365664

More details:

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

1H-1,2,3-Triazole-4-carboxamide, N-[1-(2,2-difluoroethyl)-4-piperidinyl]-1-(4-fluorophenyl)-5-(trifluoromethyl)- [ACD/Index Name]
N-[1-(2,2-Difluorethyl)-4-piperidinyl]-1-(4-fluorphenyl)-5-(trifluormethyl)-1H-1,2,3-triazol-4-carboxamid [German] [ACD/IUPAC Name]
N-[1-(2,2-Difluoroethyl)-4-piperidinyl]-1-(4-fluorophenyl)-5-(trifluoromethyl)-1H-1,2,3-triazole-4-carboxamide [ACD/IUPAC Name]
N-[1-(2,2-Difluoroéthyl)-4-pipéridinyl]-1-(4-fluorophényl)-5-(trifluorométhyl)-1H-1,2,3-triazole-4-carboxamide [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.572
Molar Refractivity: 90.9±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.12
ACD/LogD (pH 5.5): 0.98
ACD/BCF (pH 5.5): 1.99
ACD/KOC (pH 5.5): 31.26
ACD/LogD (pH 7.4): 1.79
ACD/BCF (pH 7.4): 12.74
ACD/KOC (pH 7.4): 200.41
Polar Surface Area: 63 Å2
Polarizability: 36.0±0.5 10-24cm3
Surface Tension: 40.1±7.0 dyne/cm
Molar Volume: 276.4±7.0 cm3

Click to predict properties on the Chemicalize site


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