ChemSpider 2D Image | 1-(4-Fluorophenyl)-4-({4-[4-methyl-6-(4-methyl-1-piperazinyl)-2-pyrimidinyl]-1-piperazinyl}carbonyl)-2-pyrrolidinone | C25H32FN7O2

1-(4-Fluorophenyl)-4-({4-[4-methyl-6-(4-methyl-1-piperazinyl)-2-pyrimidinyl]-1-piperazinyl}carbonyl)-2-pyrrolidinone

  • Molecular FormulaC25H32FN7O2
  • Average mass481.566 Da
  • Monoisotopic mass481.260162 Da
  • ChemSpider ID58317625

More details:

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

1-(4-Fluorophenyl)-4-({4-[4-methyl-6-(4-methyl-1-piperazinyl)-2-pyrimidinyl]-1-piperazinyl}carbonyl)-2-pyrrolidinone [ACD/IUPAC Name]
1-(4-Fluorophényl)-4-({4-[4-méthyl-6-(4-méthyl-1-pipérazinyl)-2-pyrimidinyl]-1-pipérazinyl}carbonyl)-2-pyrrolidinone [French] [ACD/IUPAC Name]
1-(4-Fluorphenyl)-4-({4-[4-methyl-6-(4-methyl-1-piperazinyl)-2-pyrimidinyl]-1-piperazinyl}carbonyl)-2-pyrrolidinon [German] [ACD/IUPAC Name]
2-Pyrrolidinone, 1-(4-fluorophenyl)-4-[[4-[4-methyl-6-(4-methyl-1-piperazinyl)-2-pyrimidinyl]-1-piperazinyl]carbonyl]- [ACD/Index Name]
1-(4-fluorophenyl)-4-(4-(4-methyl-6-(4-methylpiperazin-1-yl)pyrimidin-2-yl)piperazine-1-carbonyl)pyrrolidin-2-one

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

Density: 1.3±0.1 g/cm3
Boiling Point: 775.0±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 112.8±3.0 kJ/mol
Flash Point: 422.5±35.7 °C
Index of Refraction: 1.611
Molar Refractivity: 128.7±0.3 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.48
ACD/LogD (pH 5.5): -1.84
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.97
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 76 Å2
Polarizability: 51.0±0.5 10-24cm3
Surface Tension: 58.4±3.0 dyne/cm
Molar Volume: 370.8±3.0 cm3

Click to predict properties on the Chemicalize site


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