ChemSpider 2D Image | Cyclobutyl{4-[5-(2-fluorobenzyl)-2-isobutyl-6-methyl-4-pyrimidinyl]-1-piperazinyl}methanone | C25H33FN4O

Cyclobutyl{4-[5-(2-fluorobenzyl)-2-isobutyl-6-methyl-4-pyrimidinyl]-1-piperazinyl}methanone

  • Molecular FormulaC25H33FN4O
  • Average mass424.554 Da
  • Monoisotopic mass424.263855 Da
  • ChemSpider ID34429616

More details:

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

Cyclobutyl{4-[5-(2-fluorbenzyl)-2-isobutyl-6-methyl-4-pyrimidinyl]-1-piperazinyl}methanon [German] [ACD/IUPAC Name]
Cyclobutyl{4-[5-(2-fluorobenzyl)-2-isobutyl-6-methyl-4-pyrimidinyl]-1-piperazinyl}methanone [ACD/IUPAC Name]
Cyclobutyl{4-[5-(2-fluorobenzyl)-2-isobutyl-6-méthyl-4-pyrimidinyl]-1-pipérazinyl}méthanone [French] [ACD/IUPAC Name]
Methanone, cyclobutyl[4-[5-[(2-fluorophenyl)methyl]-6-methyl-2-(2-methylpropyl)-4-pyrimidinyl]-1-piperazinyl]- [ACD/Index 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: 594.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.6±3.0 kJ/mol
Flash Point: 313.3±30.1 °C
Index of Refraction: 1.575
Molar Refractivity: 120.1±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.50
ACD/LogD (pH 5.5): 2.03
ACD/BCF (pH 5.5): 5.46
ACD/KOC (pH 5.5): 24.41
ACD/LogD (pH 7.4): 3.24
ACD/BCF (pH 7.4): 89.12
ACD/KOC (pH 7.4): 398.45
Polar Surface Area: 49 Å2
Polarizability: 47.6±0.5 10-24cm3
Surface Tension: 49.9±3.0 dyne/cm
Molar Volume: 363.6±3.0 cm3

Click to predict properties on the Chemicalize site


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