ChemSpider 2D Image | 3-(4-Fluorophenyl)-N-{2-[(3-fluorophenyl)amino]-2-oxoethyl}-N-methyl-1-phenyl-1H-pyrazole-4-carboxamide | C25H20F2N4O2

3-(4-Fluorophenyl)-N-{2-[(3-fluorophenyl)amino]-2-oxoethyl}-N-methyl-1-phenyl-1H-pyrazole-4-carboxamide

  • Molecular FormulaC25H20F2N4O2
  • Average mass446.449 Da
  • Monoisotopic mass446.155426 Da
  • ChemSpider ID22410819

More details:

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

1H-Pyrazole-4-carboxamide, 3-(4-fluorophenyl)-N-[2-[(3-fluorophenyl)amino]-2-oxoethyl]-N-methyl-1-phenyl- [ACD/Index Name]
3-(4-Fluorophenyl)-N-{2-[(3-fluorophenyl)amino]-2-oxoethyl}-N-methyl-1-phenyl-1H-pyrazole-4-carboxamide [ACD/IUPAC Name]
3-(4-Fluorophényl)-N-{2-[(3-fluorophényl)amino]-2-oxoéthyl}-N-méthyl-1-phényl-1H-pyrazole-4-carboxamide [French] [ACD/IUPAC Name]
3-(4-Fluorphenyl)-N-{2-[(3-fluorphenyl)amino]-2-oxoethyl}-N-methyl-1-phenyl-1H-pyrazol-4-carboxamid [German] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 685.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 100.6±3.0 kJ/mol
Flash Point: 368.5±31.5 °C
Index of Refraction: 1.617
Molar Refractivity: 122.8±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.08
ACD/LogD (pH 5.5): 3.90
ACD/BCF (pH 5.5): 540.12
ACD/KOC (pH 5.5): 3144.25
ACD/LogD (pH 7.4): 3.90
ACD/BCF (pH 7.4): 540.11
ACD/KOC (pH 7.4): 3144.24
Polar Surface Area: 67 Å2
Polarizability: 48.7±0.5 10-24cm3
Surface Tension: 45.6±7.0 dyne/cm
Molar Volume: 351.1±7.0 cm3

Click to predict properties on the Chemicalize site


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