ChemSpider 2D Image | N-(1,3-Benzodioxol-5-ylmethyl)-5-[1-{2-[(4-methylphenyl)amino]-2-oxoethyl}-2,4-dioxo-1,4-dihydro-3(2H)-quinazolinyl]pentanamide | C30H30N4O6

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

  • Molecular FormulaC30H30N4O6
  • Average mass542.582 Da
  • Monoisotopic mass542.216553 Da
  • ChemSpider ID13120565

More details:

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

3(2H)-Quinazolinepentanamide, N-(1,3-benzodioxol-5-ylmethyl)-1,4-dihydro-1-[2-[(4-methylphenyl)amino]-2-oxoethyl]-2,4-dioxo- [ACD/Index Name]
N-(1,3-Benzodioxol-5-ylmethyl)-5-[1-{2-[(4-methylphenyl)amino]-2-oxoethyl}-2,4-dioxo-1,4-dihydro-3(2H)-chinazolinyl]pentanamid [German] [ACD/IUPAC Name]
N-(1,3-Benzodioxol-5-ylmethyl)-5-[1-{2-[(4-methylphenyl)amino]-2-oxoethyl}-2,4-dioxo-1,4-dihydro-3(2H)-quinazolinyl]pentanamide [ACD/IUPAC Name]
N-(1,3-Benzodioxol-5-ylméthyl)-5-[1-{2-[(4-méthylphényl)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: 1.639
Molar Refractivity: 146.7±0.3 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 4.09
ACD/LogD (pH 5.5): 3.42
ACD/BCF (pH 5.5): 232.25
ACD/KOC (pH 5.5): 1718.52
ACD/LogD (pH 7.4): 3.42
ACD/BCF (pH 7.4): 232.26
ACD/KOC (pH 7.4): 1718.57
Polar Surface Area: 117 Å2
Polarizability: 58.2±0.5 10-24cm3
Surface Tension: 60.4±3.0 dyne/cm
Molar Volume: 407.6±3.0 cm3

Click to predict properties on the Chemicalize site


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