ChemSpider 2D Image | 3-(1,3-Benzodioxol-5-ylmethyl)-N-cyclohexyl-1-{2-[(4-isopropylphenyl)amino]-2-oxoethyl}-2,4-dioxo-1,2,3,4-tetrahydro-7-quinazolinecarboxamide | C34H36N4O6

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

  • Molecular FormulaC34H36N4O6
  • Average mass596.673 Da
  • Monoisotopic mass596.263489 Da
  • ChemSpider ID22464950

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]-3,4-dihydro-N-[4-(1-methylethyl)phenyl]-2,4-dioxo- [ACD/Index Name]
3-(1,3-Benzodioxol-5-ylmethyl)-N-cyclohexyl-1-{2-[(4-isopropylphenyl)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-[(4-isopropylphenyl)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-[(4-isopropylphényl)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: 1.667
Molar Refractivity: 163.1±0.4 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 3
ACD/LogP: 6.09
ACD/LogD (pH 5.5): 4.65
ACD/BCF (pH 5.5): 2003.21
ACD/KOC (pH 5.5): 8034.69
ACD/LogD (pH 7.4): 4.65
ACD/BCF (pH 7.4): 2003.26
ACD/KOC (pH 7.4): 8034.89
Polar Surface Area: 117 Å2
Polarizability: 64.6±0.5 10-24cm3
Surface Tension: 68.8±5.0 dyne/cm
Molar Volume: 438.1±5.0 cm3

Click to predict properties on the Chemicalize site


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