ChemSpider 2D Image | N-Benzyl-2-methyl-4-[3-(3-methylphenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]-1-piperazinecarboxamide | C29H29N7O

N-Benzyl-2-methyl-4-[3-(3-methylphenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]-1-piperazinecarboxamide

  • Molecular FormulaC29H29N7O
  • Average mass491.587 Da
  • Monoisotopic mass491.243347 Da
  • ChemSpider ID22731494

More details:

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

1-Piperazinecarboxamide, 2-methyl-4-[3-(3-methylphenyl)-1,2,4-triazolo[4,3-c]quinazolin-5-yl]-N-(phenylmethyl)- [ACD/Index Name]
N-Benzyl-2-methyl-4-[3-(3-methylphenyl)[1,2,4]triazolo[4,3-c]chinazolin-5-yl]-1-piperazincarboxamid [German] [ACD/IUPAC Name]
N-Benzyl-2-methyl-4-[3-(3-methylphenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]-1-piperazinecarboxamide [ACD/IUPAC Name]
N-Benzyl-2-méthyl-4-[3-(3-méthylphényl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]-1-pipérazinecarboxamide [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.705
Molar Refractivity: 145.5±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.80
ACD/LogD (pH 5.5): 3.84
ACD/BCF (pH 5.5): 486.65
ACD/KOC (pH 5.5): 2917.90
ACD/LogD (pH 7.4): 3.84
ACD/BCF (pH 7.4): 486.82
ACD/KOC (pH 7.4): 2918.89
Polar Surface Area: 79 Å2
Polarizability: 57.7±0.5 10-24cm3
Surface Tension: 54.5±7.0 dyne/cm
Molar Volume: 374.5±7.0 cm3

Click to predict properties on the Chemicalize site


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