ChemSpider 2D Image | 4-{[1-(2-Chloro-6-fluorobenzyl)-6,7-dimethoxy-2,4-dioxo-1,4-dihydro-3(2H)-quinazolinyl]methyl}-N-isopropylbenzamide | C28H27ClFN3O5

4-{[1-(2-Chloro-6-fluorobenzyl)-6,7-dimethoxy-2,4-dioxo-1,4-dihydro-3(2H)-quinazolinyl]methyl}-N-isopropylbenzamide

  • Molecular FormulaC28H27ClFN3O5
  • Average mass539.982 Da
  • Monoisotopic mass539.162354 Da
  • ChemSpider ID29064106

More details:

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

4-{[1-(2-Chlor-6-fluorbenzyl)-6,7-dimethoxy-2,4-dioxo-1,4-dihydro-3(2H)-chinazolinyl]methyl}-N-isopropylbenzamid [German] [ACD/IUPAC Name]
4-{[1-(2-Chloro-6-fluorobenzyl)-6,7-dimethoxy-2,4-dioxo-1,4-dihydro-3(2H)-quinazolinyl]methyl}-N-isopropylbenzamide [ACD/IUPAC Name]
4-{[1-(2-Chloro-6-fluorobenzyl)-6,7-diméthoxy-2,4-dioxo-1,4-dihydro-3(2H)-quinazolinyl]méthyl}-N-isopropylbenzamide [French] [ACD/IUPAC Name]
Benzamide, 4-[[1-[(2-chloro-6-fluorophenyl)methyl]-1,4-dihydro-6,7-dimethoxy-2,4-dioxo-3(2H)-quinazolinyl]methyl]-N-(1-methylethyl)- [ACD/Index Name]
1184998-55-7 [RN]
4-((1-(2-chloro-6-fluorobenzyl)-6,7-dimethoxy-2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)methyl)-N-isopropylbenzamide
4-({1-[(2-chloro-6-fluorophenyl)methyl]-6,7-dimethoxy-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl}methyl)-N-(propan-2-yl)benzamide
4-{[1-(2-chloro-6-fluorobenzyl)-6,7-dimethoxy-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl]methyl}-N-isopropylbenzamide

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: 140.6±0.3 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 4.42
ACD/LogD (pH 5.5): 4.71
ACD/BCF (pH 5.5): 2228.22
ACD/KOC (pH 5.5): 8670.92
ACD/LogD (pH 7.4): 4.71
ACD/BCF (pH 7.4): 2228.22
ACD/KOC (pH 7.4): 8670.92
Polar Surface Area: 88 Å2
Polarizability: 55.8±0.5 10-24cm3
Surface Tension: 52.9±3.0 dyne/cm
Molar Volume: 405.9±3.0 cm3

Click to predict properties on the Chemicalize site


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