ChemSpider 2D Image | 1-{[3-(4-Fluorophenyl)-1-(4-methylphenyl)-1H-pyrazol-4-yl]methyl}-3-(methoxymethyl)piperidine | C24H28FN3O

1-{[3-(4-Fluorophenyl)-1-(4-methylphenyl)-1H-pyrazol-4-yl]methyl}-3-(methoxymethyl)piperidine

  • Molecular FormulaC24H28FN3O
  • Average mass393.497 Da
  • Monoisotopic mass393.221649 Da
  • ChemSpider ID23054758

More details:

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

1-{[3-(4-Fluorophenyl)-1-(4-methylphenyl)-1H-pyrazol-4-yl]methyl}-3-(methoxymethyl)piperidine [ACD/IUPAC Name]
1-{[3-(4-Fluorophényl)-1-(4-méthylphényl)-1H-pyrazol-4-yl]méthyl}-3-(méthoxyméthyl)pipéridine [French] [ACD/IUPAC Name]
1-{[3-(4-Fluorphenyl)-1-(4-methylphenyl)-1H-pyrazol-4-yl]methyl}-3-(methoxymethyl)piperidin [German] [ACD/IUPAC Name]
Piperidine, 1-[[3-(4-fluorophenyl)-1-(4-methylphenyl)-1H-pyrazol-4-yl]methyl]-3-(methoxymethyl)- [ACD/Index Name]
1-{[3-(4-FLUOROPHENYL)-1-(4-METHYLPHENYL)PYRAZOL-4-YL]METHYL}-3-(METHOXYMETHYL)PIPERIDINE

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

Density: 1.2±0.1 g/cm3
Boiling Point: 513.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.5±3.0 kJ/mol
Flash Point: 264.2±30.1 °C
Index of Refraction: 1.593
Molar Refractivity: 114.8±0.5 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.63
ACD/LogD (pH 5.5): 2.48
ACD/BCF (pH 5.5): 10.97
ACD/KOC (pH 5.5): 36.00
ACD/LogD (pH 7.4): 4.17
ACD/BCF (pH 7.4): 538.47
ACD/KOC (pH 7.4): 1766.65
Polar Surface Area: 30 Å2
Polarizability: 45.5±0.5 10-24cm3
Surface Tension: 40.5±7.0 dyne/cm
Molar Volume: 338.6±7.0 cm3

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