ChemSpider 2D Image | N-[2-(Benzylamino)-2-oxoethyl]-1-(4-fluorophenyl)-5-(trifluoromethyl)-1H-1,2,3-triazole-4-carboxamide | C19H15F4N5O2

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

  • Molecular FormulaC19H15F4N5O2
  • Average mass421.348 Da
  • Monoisotopic mass421.116180 Da
  • ChemSpider ID34361263

More details:

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

1H-1,2,3-Triazole-4-carboxamide, 1-(4-fluorophenyl)-N-[2-oxo-2-[(phenylmethyl)amino]ethyl]-5-(trifluoromethyl)- [ACD/Index Name]
N-[2-(Benzylamino)-2-oxoethyl]-1-(4-fluorophenyl)-5-(trifluoromethyl)-1H-1,2,3-triazole-4-carboxamide [ACD/IUPAC Name]
N-[2-(Benzylamino)-2-oxoéthyl]-1-(4-fluorophényl)-5-(trifluorométhyl)-1H-1,2,3-triazole-4-carboxamide [French] [ACD/IUPAC Name]
N-[2-(Benzylamino)-2-oxoethyl]-1-(4-fluorphenyl)-5-(trifluormethyl)-1H-1,2,3-triazol-4-carboxamid [German] [ACD/IUPAC 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: 1.599
Molar Refractivity: 100.4±0.5 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.54
ACD/LogD (pH 5.5): 1.80
ACD/BCF (pH 5.5): 13.63
ACD/KOC (pH 5.5): 222.38
ACD/LogD (pH 7.4): 1.11
ACD/BCF (pH 7.4): 2.76
ACD/KOC (pH 7.4): 45.09
Polar Surface Area: 89 Å2
Polarizability: 39.8±0.5 10-24cm3
Surface Tension: 45.6±7.0 dyne/cm
Molar Volume: 293.9±7.0 cm3

Click to predict properties on the Chemicalize site


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