ChemSpider 2D Image | 4-(1-Methyl-5-oxo-4-phenyl-4,5-dihydro-1H-1,2,4-triazol-3-yl)-N-[3-(trifluoromethyl)phenyl]-1-piperidinecarboxamide | C22H22F3N5O2

4-(1-Methyl-5-oxo-4-phenyl-4,5-dihydro-1H-1,2,4-triazol-3-yl)-N-[3-(trifluoromethyl)phenyl]-1-piperidinecarboxamide

  • Molecular FormulaC22H22F3N5O2
  • Average mass445.438 Da
  • Monoisotopic mass445.172546 Da
  • ChemSpider ID30748436

More details:

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

1-Piperidinecarboxamide, 4-(4,5-dihydro-1-methyl-5-oxo-4-phenyl-1H-1,2,4-triazol-3-yl)-N-[3-(trifluoromethyl)phenyl]- [ACD/Index Name]
4-(1-Methyl-5-oxo-4-phenyl-4,5-dihydro-1H-1,2,4-triazol-3-yl)-N-[3-(trifluormethyl)phenyl]-1-piperidincarboxamid [German] [ACD/IUPAC Name]
4-(1-Methyl-5-oxo-4-phenyl-4,5-dihydro-1H-1,2,4-triazol-3-yl)-N-[3-(trifluoromethyl)phenyl]-1-piperidinecarboxamide [ACD/IUPAC Name]
4-(1-Méthyl-5-oxo-4-phényl-4,5-dihydro-1H-1,2,4-triazol-3-yl)-N-[3-(trifluorométhyl)phényl]-1-pipéridinecarboxamide [French] [ACD/IUPAC Name]
1421474-71-6 [RN]
4-(1-methyl-5-oxo-4-phenyl-4,5-dihydro-1H-1,2,4-triazol-3-yl)-N-(3-(trifluoromethyl)phenyl)piperidine-1-carboxamide
4-(1-methyl-5-oxo-4-phenyl-4,5-dihydro-1H-1,2,4-triazol-3-yl)-N-[3-(trifluoromethyl)phenyl]piperidine-1-carboxamide

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: 1.622
Molar Refractivity: 113.4±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.30
ACD/LogD (pH 5.5): 3.02
ACD/BCF (pH 5.5): 114.34
ACD/KOC (pH 5.5): 1013.63
ACD/LogD (pH 7.4): 3.05
ACD/BCF (pH 7.4): 122.84
ACD/KOC (pH 7.4): 1089.06
Polar Surface Area: 68 Å2
Polarizability: 44.9±0.5 10-24cm3
Surface Tension: 47.6±7.0 dyne/cm
Molar Volume: 321.9±7.0 cm3

Click to predict properties on the Chemicalize site


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