ChemSpider 2D Image | Methyl 3-(2-chlorobenzyl)-7-cyclopropyl-1-(2-methoxyphenyl)-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-5-carboxylate | C26H22ClN3O5

Methyl 3-(2-chlorobenzyl)-7-cyclopropyl-1-(2-methoxyphenyl)-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-5-carboxylate

  • Molecular FormulaC26H22ClN3O5
  • Average mass491.923 Da
  • Monoisotopic mass491.124786 Da
  • ChemSpider ID21637897

More details:

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

3-(2-Chlorobenzyl)-7-cyclopropyl-1-(2-méthoxyphényl)-2,4-dioxo-1,2,3,4-tétrahydropyrido[2,3-d]pyrimidine-5-carboxylate de méthyle [French] [ACD/IUPAC Name]
Methyl 3-(2-chlorobenzyl)-7-cyclopropyl-1-(2-methoxyphenyl)-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-5-carboxylate [ACD/IUPAC Name]
Methyl-3-(2-chlorbenzyl)-7-cyclopropyl-1-(2-methoxyphenyl)-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidin-5-carboxylat [German] [ACD/IUPAC Name]
Pyrido[2,3-d]pyrimidine-5-carboxylic acid, 3-[(2-chlorophenyl)methyl]-7-cyclopropyl-1,2,3,4-tetrahydro-1-(2-methoxyphenyl)-2,4-dioxo-, methyl ester [ACD/Index Name]
3-(2-Chloro-benzyl)-7-cyclopropyl-1-(2-methoxy-phenyl)-2,4-dioxo-1,2,3,4-tetrahydro-pyrido[2,3-d]pyrimidine-5-carboxylic acid methyl ester
methyl 3-[(2-chlorophenyl)methyl]-7-cyclopropyl-1-(2-methoxyphenyl)-2,4-dioxo-1,3-dihydropyridino[2,3-d]pyrimidine-5-carboxylate
MFCD09779664

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.4±0.1 g/cm3
Boiling Point: 686.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 100.6±3.0 kJ/mol
Flash Point: 368.9±34.3 °C
Index of Refraction: 1.657
Molar Refractivity: 128.3±0.3 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.86
ACD/LogD (pH 5.5): 4.47
ACD/BCF (pH 5.5): 1462.04
ACD/KOC (pH 5.5): 6413.23
ACD/LogD (pH 7.4): 4.47
ACD/BCF (pH 7.4): 1462.05
ACD/KOC (pH 7.4): 6413.25
Polar Surface Area: 89 Å2
Polarizability: 50.9±0.5 10-24cm3
Surface Tension: 63.6±3.0 dyne/cm
Molar Volume: 348.9±3.0 cm3

Click to predict properties on the Chemicalize site


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