ChemSpider 2D Image | Ethyl 6-{[4-(diphenylmethyl)-1-piperazinyl]methyl}-4-(4-methoxyphenyl)-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate | C32H36N4O4

Ethyl 6-{[4-(diphenylmethyl)-1-piperazinyl]methyl}-4-(4-methoxyphenyl)-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate

  • Molecular FormulaC32H36N4O4
  • Average mass540.653 Da
  • Monoisotopic mass540.273682 Da
  • ChemSpider ID21470670

More details:

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

5-Pyrimidinecarboxylic acid, 6-[[4-(diphenylmethyl)-1-piperazinyl]methyl]-1,2,3,4-tetrahydro-4-(4-methoxyphenyl)-2-oxo-, ethyl ester [ACD/Index Name]
6-{[4-(Diphénylméthyl)-1-pipérazinyl]méthyl}-4-(4-méthoxyphényl)-2-oxo-1,2,3,4-tétrahydro-5-pyrimidinecarboxylate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 6-{[4-(diphenylmethyl)-1-piperazinyl]methyl}-4-(4-methoxyphenyl)-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate [ACD/IUPAC Name]
Ethyl-6-{[4-(diphenylmethyl)-1-piperazinyl]methyl}-4-(4-methoxyphenyl)-2-oxo-1,2,3,4-tetrahydro-5-pyrimidincarboxylat [German] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 655.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 96.5±3.0 kJ/mol
Flash Point: 350.0±31.5 °C
Index of Refraction: 1.596
Molar Refractivity: 153.4±0.3 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 4.69
ACD/LogD (pH 5.5): 2.25
ACD/BCF (pH 5.5): 10.80
ACD/KOC (pH 5.5): 56.05
ACD/LogD (pH 7.4): 3.83
ACD/BCF (pH 7.4): 406.84
ACD/KOC (pH 7.4): 2111.34
Polar Surface Area: 83 Å2
Polarizability: 60.8±0.5 10-24cm3
Surface Tension: 48.1±3.0 dyne/cm
Molar Volume: 450.9±3.0 cm3

Click to predict properties on the Chemicalize site


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