ChemSpider 2D Image | 3-Cyclopentyl-1-{4-[5-(2,5-dimethylbenzyl)-6-methyl-2-phenyl-4-pyrimidinyl]-1-piperazinyl}-1-propanone | C32H40N4O

3-Cyclopentyl-1-{4-[5-(2,5-dimethylbenzyl)-6-methyl-2-phenyl-4-pyrimidinyl]-1-piperazinyl}-1-propanone

  • Molecular FormulaC32H40N4O
  • Average mass496.686 Da
  • Monoisotopic mass496.320221 Da
  • ChemSpider ID21577283

More details:

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

1-Propanone, 3-cyclopentyl-1-[4-[5-[(2,5-dimethylphenyl)methyl]-6-methyl-2-phenyl-4-pyrimidinyl]-1-piperazinyl]- [ACD/Index Name]
3-Cyclopentyl-1-{4-[5-(2,5-dimethylbenzyl)-6-methyl-2-phenyl-4-pyrimidinyl]-1-piperazinyl}-1-propanon [German] [ACD/IUPAC Name]
3-Cyclopentyl-1-{4-[5-(2,5-dimethylbenzyl)-6-methyl-2-phenyl-4-pyrimidinyl]-1-piperazinyl}-1-propanone [ACD/IUPAC Name]
3-Cyclopentyl-1-{4-[5-(2,5-diméthylbenzyl)-6-méthyl-2-phényl-4-pyrimidinyl]-1-pipérazinyl}-1-propanone [French] [ACD/IUPAC Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 626.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 92.8±3.0 kJ/mol
Flash Point: 332.8±31.5 °C
Index of Refraction: 1.586
Molar Refractivity: 149.5±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 6.95
ACD/LogD (pH 5.5): 4.41
ACD/BCF (pH 5.5): 409.17
ACD/KOC (pH 5.5): 635.61
ACD/LogD (pH 7.4): 5.95
ACD/BCF (pH 7.4): 14047.68
ACD/KOC (pH 7.4): 21821.63
Polar Surface Area: 49 Å2
Polarizability: 59.3±0.5 10-24cm3
Surface Tension: 47.9±3.0 dyne/cm
Molar Volume: 445.2±3.0 cm3

Click to predict properties on the Chemicalize site


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