ChemSpider 2D Image | 2-{4-[3-(1H-1,2,4-Triazol-1-yl)propanoyl]-1-piperazinyl}-N-[2-(trifluoromethyl)phenyl]acetamide | C18H21F3N6O2

2-{4-[3-(1H-1,2,4-Triazol-1-yl)propanoyl]-1-piperazinyl}-N-[2-(trifluoromethyl)phenyl]acetamide

  • Molecular FormulaC18H21F3N6O2
  • Average mass410.393 Da
  • Monoisotopic mass410.167816 Da
  • ChemSpider ID21656507

More details:

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

1-Piperazineacetamide, 4-[1-oxo-3-(1H-1,2,4-triazol-1-yl)propyl]-N-[2-(trifluoromethyl)phenyl]- [ACD/Index Name]
2-{4-[3-(1H-1,2,4-Triazol-1-yl)propanoyl]-1-piperazinyl}-N-[2-(trifluormethyl)phenyl]acetamid [German] [ACD/IUPAC Name]
2-{4-[3-(1H-1,2,4-Triazol-1-yl)propanoyl]-1-piperazinyl}-N-[2-(trifluoromethyl)phenyl]acetamide [ACD/IUPAC Name]
2-{4-[3-(1H-1,2,4-Triazol-1-yl)propanoyl]-1-pipérazinyl}-N-[2-(trifluorométhyl)phényl]acétamide [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: 1.607
Molar Refractivity: 100.7±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 0.30
ACD/LogD (pH 5.5): 0.86
ACD/BCF (pH 5.5): 2.64
ACD/KOC (pH 5.5): 69.42
ACD/LogD (pH 7.4): 0.86
ACD/BCF (pH 7.4): 2.67
ACD/KOC (pH 7.4): 70.28
Polar Surface Area: 83 Å2
Polarizability: 39.9±0.5 10-24cm3
Surface Tension: 49.3±7.0 dyne/cm
Molar Volume: 291.8±7.0 cm3

Click to predict properties on the Chemicalize site


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