ChemSpider 2D Image | N-(4-{[4-(Dimethylamino)-2-quinazolinyl]amino}cyclohexyl)-2-(1-methyl-1H-indol-3-yl)-4-(4-methylphenyl)-4-oxobutanamide | C36H40N6O2

N-(4-{[4-(Dimethylamino)-2-quinazolinyl]amino}cyclohexyl)-2-(1-methyl-1H-indol-3-yl)-4-(4-methylphenyl)-4-oxobutanamide

  • Molecular FormulaC36H40N6O2
  • Average mass588.742 Da
  • Monoisotopic mass588.321289 Da
  • ChemSpider ID8407629

More details:

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

1H-Indole-3-acetamide, N-[4-[[4-(dimethylamino)-2-quinazolinyl]amino]cyclohexyl]-1-methyl-α-[2-(4-methylphenyl)-2-oxoethyl]- [ACD/Index Name]
N-(4-{[4-(Dimethylamino)-2-chinazolinyl]amino}cyclohexyl)-2-(1-methyl-1H-indol-3-yl)-4-(4-methylphenyl)-4-oxobutanamid [German] [ACD/IUPAC Name]
N-(4-{[4-(Dimethylamino)-2-quinazolinyl]amino}cyclohexyl)-2-(1-methyl-1H-indol-3-yl)-4-(4-methylphenyl)-4-oxobutanamide [ACD/IUPAC Name]
N-(4-{[4-(Diméthylamino)-2-quinazolinyl]amino}cyclohexyl)-2-(1-méthyl-1H-indol-3-yl)-4-(4-méthylphényl)-4-oxobutanamide [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.661
Molar Refractivity: 174.3±0.5 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 5.89
ACD/LogD (pH 5.5): 3.70
ACD/BCF (pH 5.5): 101.44
ACD/KOC (pH 5.5): 197.43
ACD/LogD (pH 7.4): 4.91
ACD/BCF (pH 7.4): 1631.68
ACD/KOC (pH 7.4): 3175.77
Polar Surface Area: 92 Å2
Polarizability: 69.1±0.5 10-24cm3
Surface Tension: 48.5±7.0 dyne/cm
Molar Volume: 471.4±7.0 cm3

Click to predict properties on the Chemicalize site


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