ChemSpider 2D Image | Ethyl 3-{2-[(3-chlorophenyl)amino]-2-oxoethyl}-2-(4-fluorophenyl)-4-oxo-4,5,6,8-tetrahydropyrido[3,4-d]pyrimidine-7(3H)-carboxylate | C24H22ClFN4O4

Ethyl 3-{2-[(3-chlorophenyl)amino]-2-oxoethyl}-2-(4-fluorophenyl)-4-oxo-4,5,6,8-tetrahydropyrido[3,4-d]pyrimidine-7(3H)-carboxylate

  • Molecular FormulaC24H22ClFN4O4
  • Average mass484.907 Da
  • Monoisotopic mass484.131348 Da
  • ChemSpider ID29177142

More details:

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

3-{2-[(3-Chlorophényl)amino]-2-oxoéthyl}-2-(4-fluorophényl)-4-oxo-4,5,6,8-tétrahydropyrido[3,4-d]pyrimidine-7(3H)-carboxylate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 3-{2-[(3-chlorophenyl)amino]-2-oxoethyl}-2-(4-fluorophenyl)-4-oxo-4,5,6,8-tetrahydropyrido[3,4-d]pyrimidine-7(3H)-carboxylate [ACD/IUPAC Name]
Ethyl-3-{2-[(3-chlorphenyl)amino]-2-oxoethyl}-2-(4-fluorphenyl)-4-oxo-4,5,6,8-tetrahydropyrido[3,4-d]pyrimidin-7(3H)-carboxylat [German] [ACD/IUPAC Name]
Pyrido[3,4-d]pyrimidine-7(3H)-carboxylic acid, 3-[2-[(3-chlorophenyl)amino]-2-oxoethyl]-2-(4-fluorophenyl)-4,5,6,8-tetrahydro-4-oxo-, ethyl ester [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.646
Molar Refractivity: 125.2±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.62
ACD/LogD (pH 5.5): 3.19
ACD/BCF (pH 5.5): 157.59
ACD/KOC (pH 5.5): 1301.97
ACD/LogD (pH 7.4): 3.19
ACD/BCF (pH 7.4): 157.59
ACD/KOC (pH 7.4): 1301.97
Polar Surface Area: 91 Å2
Polarizability: 49.6±0.5 10-24cm3
Surface Tension: 52.1±7.0 dyne/cm
Molar Volume: 345.1±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement