ChemSpider 2D Image | N-[2-(4-Chlorophenyl)ethyl]-4-[1-{2-[(2,6-dimethylphenyl)amino]-2-oxoethyl}-2,4-dioxo-1,4-dihydro-3(2H)-quinazolinyl]butanamide | C30H31ClN4O4

N-[2-(4-Chlorophenyl)ethyl]-4-[1-{2-[(2,6-dimethylphenyl)amino]-2-oxoethyl}-2,4-dioxo-1,4-dihydro-3(2H)-quinazolinyl]butanamide

  • Molecular FormulaC30H31ClN4O4
  • Average mass547.044 Da
  • Monoisotopic mass546.203369 Da
  • ChemSpider ID20242752

More details:

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

3(2H)-Quinazolinebutanamide, N-[2-(4-chlorophenyl)ethyl]-1-[2-[(2,6-dimethylphenyl)amino]-2-oxoethyl]-1,4-dihydro-2,4-dioxo- [ACD/Index Name]
N-[2-(4-Chlorophenyl)ethyl]-4-[1-{2-[(2,6-dimethylphenyl)amino]-2-oxoethyl}-2,4-dioxo-1,4-dihydro-3(2H)-quinazolinyl]butanamide [ACD/IUPAC Name]
N-[2-(4-Chlorophényl)éthyl]-4-[1-{2-[(2,6-diméthylphényl)amino]-2-oxoéthyl}-2,4-dioxo-1,4-dihydro-3(2H)-quinazolinyl]butanamide [French] [ACD/IUPAC Name]
N-[2-(4-Chlorphenyl)ethyl]-4-[1-{2-[(2,6-dimethylphenyl)amino]-2-oxoethyl}-2,4-dioxo-1,4-dihydro-3(2H)-chinazolinyl]butanamid [German] [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: 1.626
Molar Refractivity: 150.3±0.3 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 5.36
ACD/LogD (pH 5.5): 4.93
ACD/BCF (pH 5.5): 3306.80
ACD/KOC (pH 5.5): 11501.74
ACD/LogD (pH 7.4): 4.93
ACD/BCF (pH 7.4): 3307.41
ACD/KOC (pH 7.4): 11503.86
Polar Surface Area: 99 Å2
Polarizability: 59.6±0.5 10-24cm3
Surface Tension: 56.5±3.0 dyne/cm
Molar Volume: 424.7±3.0 cm3

Click to predict properties on the Chemicalize site


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