ChemSpider 2D Image | N-(1,3-Benzodioxol-5-ylmethyl)-1-{2-[(4-methylphenyl)amino]-2-oxoethyl}-2,4-dioxo-3-phenyl-1,2,3,4-tetrahydro-7-quinazolinecarboxamide | C32H26N4O6

N-(1,3-Benzodioxol-5-ylmethyl)-1-{2-[(4-methylphenyl)amino]-2-oxoethyl}-2,4-dioxo-3-phenyl-1,2,3,4-tetrahydro-7-quinazolinecarboxamide

  • Molecular FormulaC32H26N4O6
  • Average mass562.572 Da
  • Monoisotopic mass562.185242 Da
  • ChemSpider ID13148931

More details:

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

1(2H)-Quinazolineacetamide, 7-[[(1,3-benzodioxol-5-ylmethyl)amino]carbonyl]-3,4-dihydro-N-(4-methylphenyl)-2,4-dioxo-3-phenyl- [ACD/Index Name]
N-(1,3-Benzodioxol-5-ylmethyl)-1-{2-[(4-methylphenyl)amino]-2-oxoethyl}-2,4-dioxo-3-phenyl-1,2,3,4-tetrahydro-7-chinazolincarboxamid [German] [ACD/IUPAC Name]
N-(1,3-Benzodioxol-5-ylmethyl)-1-{2-[(4-methylphenyl)amino]-2-oxoethyl}-2,4-dioxo-3-phenyl-1,2,3,4-tetrahydro-7-quinazolinecarboxamide [ACD/IUPAC Name]
N-(1,3-Benzodioxol-5-ylméthyl)-1-{2-[(4-méthylphényl)amino]-2-oxoéthyl}-2,4-dioxo-3-phényl-1,2,3,4-tétrahydro-7-quinazolinecarboxamide [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: 1.687
Molar Refractivity: 153.3±0.3 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 3.91
ACD/LogD (pH 5.5): 3.35
ACD/BCF (pH 5.5): 206.78
ACD/KOC (pH 5.5): 1581.42
ACD/LogD (pH 7.4): 3.35
ACD/BCF (pH 7.4): 206.79
ACD/KOC (pH 7.4): 1581.46
Polar Surface Area: 117 Å2
Polarizability: 60.8±0.5 10-24cm3
Surface Tension: 66.2±3.0 dyne/cm
Molar Volume: 402.6±3.0 cm3

Click to predict properties on the Chemicalize site


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