ChemSpider 2D Image | 1-{5-[(3,5-Dinitrobenzoyl)amino]-1-phenyl-1H-1,2,4-triazol-3-yl}-4-piperidinecarboxamide | C21H20N8O6

1-{5-[(3,5-Dinitrobenzoyl)amino]-1-phenyl-1H-1,2,4-triazol-3-yl}-4-piperidinecarboxamide

  • Molecular FormulaC21H20N8O6
  • Average mass480.434 Da
  • Monoisotopic mass480.150574 Da
  • ChemSpider ID123918253

More details:

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

1-{5-[(3,5-Dinitrobenzoyl)amino]-1-phenyl-1H-1,2,4-triazol-3-yl}-4-piperidincarboxamid [German] [ACD/IUPAC Name]
1-{5-[(3,5-Dinitrobenzoyl)amino]-1-phenyl-1H-1,2,4-triazol-3-yl}-4-piperidinecarboxamide [ACD/IUPAC Name]
1-{5-[(3,5-Dinitrobenzoyl)amino]-1-phényl-1H-1,2,4-triazol-3-yl}-4-pipéridinecarboxamide [French] [ACD/IUPAC Name]
4-Piperidinecarboxamide, 1-[5-[(3,5-dinitrobenzoyl)amino]-1-phenyl-1H-1,2,4-triazol-3-yl]- [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.762
Molar Refractivity: 121.1±0.5 cm3
#H bond acceptors: 14
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 1.37
ACD/LogD (pH 5.5): 1.98
ACD/BCF (pH 5.5): 18.49
ACD/KOC (pH 5.5): 277.71
ACD/LogD (pH 7.4): 1.99
ACD/BCF (pH 7.4): 19.17
ACD/KOC (pH 7.4): 287.96
Polar Surface Area: 198 Å2
Polarizability: 48.0±0.5 10-24cm3
Surface Tension: 81.4±7.0 dyne/cm
Molar Volume: 293.9±7.0 cm3

Click to predict properties on the Chemicalize site


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