ChemSpider 2D Image | Methyl 3-({6,7-dimethoxy-3-[4-(methylcarbamoyl)benzyl]-2,4-dioxo-3,4-dihydro-1(2H)-quinazolinyl}methyl)-4-methoxybenzoate | C29H29N3O8

Methyl 3-({6,7-dimethoxy-3-[4-(methylcarbamoyl)benzyl]-2,4-dioxo-3,4-dihydro-1(2H)-quinazolinyl}methyl)-4-methoxybenzoate

  • Molecular FormulaC29H29N3O8
  • Average mass547.556 Da
  • Monoisotopic mass547.195435 Da
  • ChemSpider ID29064008

More details:

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

3-({6,7-Diméthoxy-3-[4-(méthylcarbamoyl)benzyl]-2,4-dioxo-3,4-dihydro-1(2H)-quinazolinyl}méthyl)-4-méthoxybenzoate de méthyle [French] [ACD/IUPAC Name]
Benzoic acid, 3-[[3,4-dihydro-6,7-dimethoxy-3-[[4-[(methylamino)carbonyl]phenyl]methyl]-2,4-dioxo-1(2H)-quinazolinyl]methyl]-4-methoxy-, methyl ester [ACD/Index Name]
Methyl 3-({6,7-dimethoxy-3-[4-(methylcarbamoyl)benzyl]-2,4-dioxo-3,4-dihydro-1(2H)-quinazolinyl}methyl)-4-methoxybenzoate [ACD/IUPAC Name]
Methyl-3-({6,7-dimethoxy-3-[4-(methylcarbamoyl)benzyl]-2,4-dioxo-3,4-dihydro-1(2H)-chinazolinyl}methyl)-4-methoxybenzoat [German] [ACD/IUPAC Name]
methyl 3-{[6,7-dimethoxy-3-{4-[(methylamino)carbonyl]benzyl}-2,4-dioxo-3,4-dihydroquinazolin-1(2H)-yl]methyl}-4-methoxybenzoate

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: 1.610
Molar Refractivity: 145.0±0.3 cm3
#H bond acceptors: 11
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 3.39
ACD/LogD (pH 5.5): 3.50
ACD/BCF (pH 5.5): 267.79
ACD/KOC (pH 5.5): 1902.92
ACD/LogD (pH 7.4): 3.50
ACD/BCF (pH 7.4): 267.79
ACD/KOC (pH 7.4): 1902.92
Polar Surface Area: 124 Å2
Polarizability: 57.5±0.5 10-24cm3
Surface Tension: 54.2±3.0 dyne/cm
Molar Volume: 418.2±3.0 cm3

Click to predict properties on the Chemicalize site


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