ChemSpider 2D Image | 1-(2-Chloro-6-fluorobenzyl)-5-(4-fluorophenyl)-N-(2-propoxyphenyl)-1H-pyrazole-3-carboxamide | C26H22ClF2N3O2

1-(2-Chloro-6-fluorobenzyl)-5-(4-fluorophenyl)-N-(2-propoxyphenyl)-1H-pyrazole-3-carboxamide

  • Molecular FormulaC26H22ClF2N3O2
  • Average mass481.922 Da
  • Monoisotopic mass481.136871 Da
  • ChemSpider ID67556088

More details:

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

1-(2-Chlor-6-fluorbenzyl)-5-(4-fluorphenyl)-N-(2-propoxyphenyl)-1H-pyrazol-3-carboxamid [German] [ACD/IUPAC Name]
1-(2-Chloro-6-fluorobenzyl)-5-(4-fluorophenyl)-N-(2-propoxyphenyl)-1H-pyrazole-3-carboxamide [ACD/IUPAC Name]
1-(2-Chloro-6-fluorobenzyl)-5-(4-fluorophényl)-N-(2-propoxyphényl)-1H-pyrazole-3-carboxamide [French] [ACD/IUPAC Name]
1H-Pyrazole-3-carboxamide, 1-[(2-chloro-6-fluorophenyl)methyl]-5-(4-fluorophenyl)-N-(2-propoxyphenyl)- [ACD/Index 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: 573.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 85.9±3.0 kJ/mol
Flash Point: 300.3±30.1 °C
Index of Refraction: 1.602
Molar Refractivity: 128.6±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.99
ACD/LogD (pH 5.5): 5.24
ACD/BCF (pH 5.5): 5644.34
ACD/KOC (pH 5.5): 16865.00
ACD/LogD (pH 7.4): 5.24
ACD/BCF (pH 7.4): 5641.56
ACD/KOC (pH 7.4): 16856.71
Polar Surface Area: 56 Å2
Polarizability: 51.0±0.5 10-24cm3
Surface Tension: 42.9±7.0 dyne/cm
Molar Volume: 374.9±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement