ChemSpider 2D Image | 3-(1,3-Benzodioxol-5-ylmethyl)-N-cyclohexyl-1-{2-[(2,6-dimethylphenyl)amino]-2-oxoethyl}-2,4-dioxo-1,2,3,4-tetrahydro-7-quinazolinecarboxamide | C33H34N4O6

3-(1,3-Benzodioxol-5-ylmethyl)-N-cyclohexyl-1-{2-[(2,6-dimethylphenyl)amino]-2-oxoethyl}-2,4-dioxo-1,2,3,4-tetrahydro-7-quinazolinecarboxamide

  • Molecular FormulaC33H34N4O6
  • Average mass582.646 Da
  • Monoisotopic mass582.247864 Da
  • ChemSpider ID22464951

More details:

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

1(2H)-Quinazolineacetamide, 3-(1,3-benzodioxol-5-ylmethyl)-7-[(cyclohexylamino)carbonyl]-N-(2,6-dimethylphenyl)-3,4-dihydro-2,4-dioxo- [ACD/Index Name]
3-(1,3-Benzodioxol-5-ylmethyl)-N-cyclohexyl-1-{2-[(2,6-dimethylphenyl)amino]-2-oxoethyl}-2,4-dioxo-1,2,3,4-tetrahydro-7-chinazolincarboxamid [German] [ACD/IUPAC Name]
3-(1,3-Benzodioxol-5-ylmethyl)-N-cyclohexyl-1-{2-[(2,6-dimethylphenyl)amino]-2-oxoethyl}-2,4-dioxo-1,2,3,4-tetrahydro-7-quinazolinecarboxamide [ACD/IUPAC Name]
3-(1,3-Benzodioxol-5-ylméthyl)-N-cyclohexyl-1-{2-[(2,6-diméthylphényl)amino]-2-oxoéthyl}-2,4-dioxo-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: 1.677
Molar Refractivity: 158.5±0.4 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 3
ACD/LogP: 5.67
ACD/LogD (pH 5.5): 4.49
ACD/BCF (pH 5.5): 1523.36
ACD/KOC (pH 5.5): 6604.29
ACD/LogD (pH 7.4): 4.49
ACD/BCF (pH 7.4): 1523.63
ACD/KOC (pH 7.4): 6605.44
Polar Surface Area: 117 Å2
Polarizability: 62.8±0.5 10-24cm3
Surface Tension: 70.9±5.0 dyne/cm
Molar Volume: 421.0±5.0 cm3

Click to predict properties on the Chemicalize site


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