ChemSpider 2D Image | 1-{[1-(2,5-Dimethylphenyl)-3-phenyl-1H-pyrazol-4-yl]methyl}-4-[(1-methyl-1H-imidazol-2-yl)methyl]piperazine | C27H32N6

1-{[1-(2,5-Dimethylphenyl)-3-phenyl-1H-pyrazol-4-yl]methyl}-4-[(1-methyl-1H-imidazol-2-yl)methyl]piperazine

  • Molecular FormulaC27H32N6
  • Average mass440.583 Da
  • Monoisotopic mass440.268860 Da
  • ChemSpider ID22156805

More details:

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

1-{[1-(2,5-Dimethylphenyl)-3-phenyl-1H-pyrazol-4-yl]methyl}-4-[(1-methyl-1H-imidazol-2-yl)methyl]piperazin [German] [ACD/IUPAC Name]
1-{[1-(2,5-Dimethylphenyl)-3-phenyl-1H-pyrazol-4-yl]methyl}-4-[(1-methyl-1H-imidazol-2-yl)methyl]piperazine [ACD/IUPAC Name]
1-{[1-(2,5-Diméthylphényl)-3-phényl-1H-pyrazol-4-yl]méthyl}-4-[(1-méthyl-1H-imidazol-2-yl)méthyl]pipérazine [French] [ACD/IUPAC Name]
Piperazine, 1-[[1-(2,5-dimethylphenyl)-3-phenyl-1H-pyrazol-4-yl]methyl]-4-[(1-methyl-1H-imidazol-2-yl)methyl]- [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: 649.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 95.7±3.0 kJ/mol
Flash Point: 346.5±31.5 °C
Index of Refraction: 1.645
Molar Refractivity: 135.6±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.03
ACD/LogD (pH 5.5): 0.84
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.56
ACD/LogD (pH 7.4): 2.94
ACD/BCF (pH 7.4): 68.23
ACD/KOC (pH 7.4): 448.64
Polar Surface Area: 42 Å2
Polarizability: 53.8±0.5 10-24cm3
Surface Tension: 46.3±7.0 dyne/cm
Molar Volume: 374.2±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement