ChemSpider 2D Image | N-(2-Chlorobenzyl)-5-[1-{2-[(3-methoxyphenyl)amino]-2-oxoethyl}-2,4-dioxo-1,4-dihydro-3(2H)-quinazolinyl]pentanamide | C29H29ClN4O5

N-(2-Chlorobenzyl)-5-[1-{2-[(3-methoxyphenyl)amino]-2-oxoethyl}-2,4-dioxo-1,4-dihydro-3(2H)-quinazolinyl]pentanamide

  • Molecular FormulaC29H29ClN4O5
  • Average mass549.017 Da
  • Monoisotopic mass548.182678 Da
  • ChemSpider ID13120600

More details:

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

3(2H)-Quinazolinepentanamide, N-[(2-chlorophenyl)methyl]-1,4-dihydro-1-[2-[(3-methoxyphenyl)amino]-2-oxoethyl]-2,4-dioxo- [ACD/Index Name]
N-(2-Chlorbenzyl)-5-[1-{2-[(3-methoxyphenyl)amino]-2-oxoethyl}-2,4-dioxo-1,4-dihydro-3(2H)-chinazolinyl]pentanamid [German] [ACD/IUPAC Name]
N-(2-Chlorobenzyl)-5-[1-{2-[(3-methoxyphenyl)amino]-2-oxoethyl}-2,4-dioxo-1,4-dihydro-3(2H)-quinazolinyl]pentanamide [ACD/IUPAC Name]
N-(2-Chlorobenzyl)-5-[1-{2-[(3-méthoxyphényl)amino]-2-oxoéthyl}-2,4-dioxo-1,4-dihydro-3(2H)-quinazolinyl]pentanamide [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: 1.626
Molar Refractivity: 147.3±0.3 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 4.53
ACD/LogD (pH 5.5): 4.24
ACD/BCF (pH 5.5): 990.08
ACD/KOC (pH 5.5): 4851.78
ACD/LogD (pH 7.4): 4.24
ACD/BCF (pH 7.4): 990.09
ACD/KOC (pH 7.4): 4851.79
Polar Surface Area: 108 Å2
Polarizability: 58.4±0.5 10-24cm3
Surface Tension: 57.6±3.0 dyne/cm
Molar Volume: 416.1±3.0 cm3

Click to predict properties on the Chemicalize site


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