ChemSpider 2D Image | 4-{[1-{2-[Cyclohexyl(methyl)amino]-2-oxoethyl}-2,4-dioxo-1,4-dihydro-3(2H)-quinazolinyl]methyl}-N-(4-methylbenzyl)benzamide | C33H36N4O4

4-{[1-{2-[Cyclohexyl(methyl)amino]-2-oxoethyl}-2,4-dioxo-1,4-dihydro-3(2H)-quinazolinyl]methyl}-N-(4-methylbenzyl)benzamide

  • Molecular FormulaC33H36N4O4
  • Average mass552.663 Da
  • Monoisotopic mass552.273682 Da
  • ChemSpider ID22496862

More details:

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

1(2H)-Quinazolineacetamide, N-cyclohexyl-3,4-dihydro-N-methyl-3-[[4-[[[(4-methylphenyl)methyl]amino]carbonyl]phenyl]methyl]-2,4-dioxo- [ACD/Index Name]
4-{[1-{2-[Cyclohexyl(methyl)amino]-2-oxoethyl}-2,4-dioxo-1,4-dihydro-3(2H)-chinazolinyl]methyl}-N-(4-methylbenzyl)benzamid [German] [ACD/IUPAC Name]
4-{[1-{2-[Cyclohexyl(methyl)amino]-2-oxoethyl}-2,4-dioxo-1,4-dihydro-3(2H)-quinazolinyl]methyl}-N-(4-methylbenzyl)benzamide [ACD/IUPAC Name]
4-{[1-{2-[Cyclohexyl(méthyl)amino]-2-oxoéthyl}-2,4-dioxo-1,4-dihydro-3(2H)-quinazolinyl]méthyl}-N-(4-méthylbenzyl)benzamide [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: 1.656
Molar Refractivity: 157.3±0.4 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 5.61
ACD/LogD (pH 5.5): 5.11
ACD/BCF (pH 5.5): 4464.24
ACD/KOC (pH 5.5): 14258.79
ACD/LogD (pH 7.4): 5.11
ACD/BCF (pH 7.4): 4464.25
ACD/KOC (pH 7.4): 14258.79
Polar Surface Area: 90 Å2
Polarizability: 62.3±0.5 10-24cm3
Surface Tension: 64.6±5.0 dyne/cm
Molar Volume: 428.1±5.0 cm3

Click to predict properties on the Chemicalize site


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