ChemSpider 2D Image | Ethyl 6-{[4-(2-furoyl)-1-piperazinyl]methyl}-4-(4-methoxyphenyl)-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate | C24H28N4O6

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

  • Molecular FormulaC24H28N4O6
  • Average mass468.502 Da
  • Monoisotopic mass468.200897 Da
  • ChemSpider ID21902444

More details:

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

5-Pyrimidinecarboxylic acid, 6-[[4-(2-furanylcarbonyl)-1-piperazinyl]methyl]-1,2,3,4-tetrahydro-4-(4-methoxyphenyl)-2-oxo-, ethyl ester [ACD/Index Name]
6-{[4-(2-Furoyl)-1-pipérazinyl]méthyl}-4-(4-méthoxyphényl)-2-oxo-1,2,3,4-tétrahydro-5-pyrimidinecarboxylate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 6-{[4-(2-furoyl)-1-piperazinyl]methyl}-4-(4-methoxyphenyl)-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate [ACD/IUPAC Name]
Ethyl-6-{[4-(2-furoyl)-1-piperazinyl]methyl}-4-(4-methoxyphenyl)-2-oxo-1,2,3,4-tetrahydro-5-pyrimidincarboxylat [German] [ACD/IUPAC Name]
6-[4-(Furan-2-carbonyl)-piperazin-1-ylmethyl]-4-(4-methoxy-phenyl)-2-oxo-1,2,3,4-tetrahydro-pyrimidine-5-carboxylic acid ethyl ester
ethyl 6-{[4-(furan-2-ylcarbonyl)piperazin-1-yl]methyl}-4-(4-methoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate

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

Density: 1.3±0.1 g/cm3
Boiling Point: 624.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 92.5±3.0 kJ/mol
Flash Point: 331.4±31.5 °C
Index of Refraction: 1.575
Molar Refractivity: 121.8±0.3 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 2.61
ACD/LogD (pH 5.5): 0.06
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.59
ACD/LogD (pH 7.4): 1.51
ACD/BCF (pH 7.4): 7.41
ACD/KOC (pH 7.4): 128.75
Polar Surface Area: 113 Å2
Polarizability: 48.3±0.5 10-24cm3
Surface Tension: 49.2±3.0 dyne/cm
Molar Volume: 368.6±3.0 cm3

Click to predict properties on the Chemicalize site


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