ChemSpider 2D Image | 6-Methyl-3-{[4-(4-methylphenyl)-1-piperazinyl]carbonyl}-2-(2-phenylethyl)-1-(tetrahydro-2-furanylmethyl)-4(1H)-pyridinone | C31H37N3O3

6-Methyl-3-{[4-(4-methylphenyl)-1-piperazinyl]carbonyl}-2-(2-phenylethyl)-1-(tetrahydro-2-furanylmethyl)-4(1H)-pyridinone

  • Molecular FormulaC31H37N3O3
  • Average mass499.644 Da
  • Monoisotopic mass499.283478 Da
  • ChemSpider ID22245782

More details:

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

4(1H)-Pyridinone, 6-methyl-3-[[4-(4-methylphenyl)-1-piperazinyl]carbonyl]-2-(2-phenylethyl)-1-[(tetrahydro-2-furanyl)methyl]- [ACD/Index Name]
6-Methyl-3-{[4-(4-methylphenyl)-1-piperazinyl]carbonyl}-2-(2-phenylethyl)-1-(tetrahydro-2-furanylmethyl)-4(1H)-pyridinon [German] [ACD/IUPAC Name]
6-Methyl-3-{[4-(4-methylphenyl)-1-piperazinyl]carbonyl}-2-(2-phenylethyl)-1-(tetrahydro-2-furanylmethyl)-4(1H)-pyridinone [ACD/IUPAC Name]
6-Méthyl-3-{[4-(4-méthylphényl)-1-pipérazinyl]carbonyl}-2-(2-phényléthyl)-1-(tétrahydro-2-furanylméthyl)-4(1H)-pyridinone [French] [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: 706.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 103.4±3.0 kJ/mol
Flash Point: 381.1±32.9 °C
Index of Refraction: 1.600
Molar Refractivity: 144.6±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.57
ACD/LogD (pH 5.5): 3.48
ACD/BCF (pH 5.5): 260.57
ACD/KOC (pH 5.5): 1863.31
ACD/LogD (pH 7.4): 3.48
ACD/BCF (pH 7.4): 261.91
ACD/KOC (pH 7.4): 1872.90
Polar Surface Area: 53 Å2
Polarizability: 57.3±0.5 10-24cm3
Surface Tension: 49.4±3.0 dyne/cm
Molar Volume: 422.6±3.0 cm3

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