ChemSpider 2D Image | 2-{[(1-{[3-(4-Cyclohexylphenyl)-1-methyl-1H-pyrazol-4-yl]methyl}-4-piperidinyl)oxy]methyl}pyridine | C28H36N4O

2-{[(1-{[3-(4-Cyclohexylphenyl)-1-methyl-1H-pyrazol-4-yl]methyl}-4-piperidinyl)oxy]methyl}pyridine

  • Molecular FormulaC28H36N4O
  • Average mass444.612 Da
  • Monoisotopic mass444.288910 Da
  • ChemSpider ID22413449

More details:

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

2-{[(1-{[3-(4-Cyclohexylphenyl)-1-methyl-1H-pyrazol-4-yl]methyl}-4-piperidinyl)oxy]methyl}pyridin [German] [ACD/IUPAC Name]
2-{[(1-{[3-(4-Cyclohexylphenyl)-1-methyl-1H-pyrazol-4-yl]methyl}-4-piperidinyl)oxy]methyl}pyridine [ACD/IUPAC Name]
2-{[(1-{[3-(4-Cyclohexylphényl)-1-méthyl-1H-pyrazol-4-yl]méthyl}-4-pipéridinyl)oxy]méthyl}pyridine [French] [ACD/IUPAC Name]
Pyridine, 2-[[[1-[[3-(4-cyclohexylphenyl)-1-methyl-1H-pyrazol-4-yl]methyl]-4-piperidinyl]oxy]methyl]- [ACD/Index Name]
2-{[(1-{[3-(4-CYCLOHEXYLPHENYL)-1-METHYL-1H-PYRAZOL-4-YL]METHYL}PIPERIDIN-4-YL)OXY]METHYL}PYRIDINE
2-{[(1-{[3-(4-CYCLOHEXYLPHENYL)-1-METHYLPYRAZOL-4-YL]METHYL}PIPERIDIN-4-YL)OXY]METHYL}PYRIDINE

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

Density: 1.2±0.1 g/cm3
Boiling Point: 591.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.2±3.0 kJ/mol
Flash Point: 311.6±30.1 °C
Index of Refraction: 1.630
Molar Refractivity: 134.1±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.87
ACD/LogD (pH 5.5): 3.31
ACD/BCF (pH 5.5): 75.56
ACD/KOC (pH 5.5): 251.26
ACD/LogD (pH 7.4): 4.81
ACD/BCF (pH 7.4): 2374.94
ACD/KOC (pH 7.4): 7897.40
Polar Surface Area: 43 Å2
Polarizability: 53.2±0.5 10-24cm3
Surface Tension: 45.8±7.0 dyne/cm
Molar Volume: 377.0±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement