ChemSpider 2D Image | Methyl 3-{[2-(3-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl}-1,7-dimethyl-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-5-carboxylate | C22H19ClN4O5

Methyl 3-{[2-(3-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl}-1,7-dimethyl-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-5-carboxylate

  • Molecular FormulaC22H19ClN4O5
  • Average mass454.863 Da
  • Monoisotopic mass454.104401 Da
  • ChemSpider ID21800098

More details:






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

3-{[2-(3-Chlorophényl)-5-méthyl-1,3-oxazol-4-yl]méthyl}-1,7-diméthyl-2,4-dioxo-1,2,3,4-tétrahydropyrido[2,3-d]pyrimidine-5-carboxylate de méthyle [French] [ACD/IUPAC Name]
Methyl 3-{[2-(3-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl}-1,7-dimethyl-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-5-carboxylate [ACD/IUPAC Name]
Methyl-3-{[2-(3-chlorphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}-1,7-dimethyl-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-(3-chlorophenyl)-5-methyl-4-oxazolyl]methyl]-1,2,3,4-tetrahydro-1,7-dimethyl-2,4-dioxo-, methyl ester [ACD/Index Name]
MFCD11854867

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point: 665.6±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 97.9±3.0 kJ/mol
Flash Point: 356.3±34.3 °C
Index of Refraction: 1.618
Molar Refractivity: 114.5±0.3 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.71
ACD/LogD (pH 5.5): 3.36
ACD/BCF (pH 5.5): 209.80
ACD/KOC (pH 5.5): 1597.91
ACD/LogD (pH 7.4): 3.36
ACD/BCF (pH 7.4): 209.80
ACD/KOC (pH 7.4): 1597.94
Polar Surface Area: 106 Å2
Polarizability: 45.4±0.5 10-24cm3
Surface Tension: 59.1±3.0 dyne/cm
Molar Volume: 326.6±3.0 cm3

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