ChemSpider 2D Image | N-(2-{4-[(4-Methyl-1-piperazinyl)carbonyl]-1H-1,2,3-triazol-1-yl}ethyl)-3-(trifluoromethyl)benzamide | C18H21F3N6O2

N-(2-{4-[(4-Methyl-1-piperazinyl)carbonyl]-1H-1,2,3-triazol-1-yl}ethyl)-3-(trifluoromethyl)benzamide

  • Molecular FormulaC18H21F3N6O2
  • Average mass410.393 Da
  • Monoisotopic mass410.167816 Da
  • ChemSpider ID22129480

More details:

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

Benzamide, N-[2-[4-[(4-methyl-1-piperazinyl)carbonyl]-1H-1,2,3-triazol-1-yl]ethyl]-3-(trifluoromethyl)- [ACD/Index Name]
N-(2-{4-[(4-Methyl-1-piperazinyl)carbonyl]-1H-1,2,3-triazol-1-yl}ethyl)-3-(trifluormethyl)benzamid [German] [ACD/IUPAC Name]
N-(2-{4-[(4-Methyl-1-piperazinyl)carbonyl]-1H-1,2,3-triazol-1-yl}ethyl)-3-(trifluoromethyl)benzamide [ACD/IUPAC Name]
N-(2-{4-[(4-Méthyl-1-pipérazinyl)carbonyl]-1H-1,2,3-triazol-1-yl}éthyl)-3-(trifluorométhyl)benzamide [French] [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: 1.608
Molar Refractivity: 100.5±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: -0.25
ACD/LogD (pH 5.5): -0.68
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.68
ACD/LogD (pH 7.4): 0.25
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 31.01
Polar Surface Area: 83 Å2
Polarizability: 39.9±0.5 10-24cm3
Surface Tension: 48.0±7.0 dyne/cm
Molar Volume: 290.9±7.0 cm3

Click to predict properties on the Chemicalize site


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