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

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

  • Molecular FormulaC26H22ClF2N3O2
  • Average mass481.922 Da
  • Monoisotopic mass481.136871 Da
  • ChemSpider ID67556089

More details:

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

1-(2-Chlor-6-fluorbenzyl)-5-(4-fluorphenyl)-N-(2-isopropoxyphenyl)-1H-pyrazol-3-carboxamid [German] [ACD/IUPAC Name]
1-(2-Chloro-6-fluorobenzyl)-5-(4-fluorophenyl)-N-(2-isopropoxyphenyl)-1H-pyrazole-3-carboxamide [ACD/IUPAC Name]
1-(2-Chloro-6-fluorobenzyl)-5-(4-fluorophényl)-N-(2-isopropoxyphényl)-1H-pyrazole-3-carboxamide [French] [ACD/IUPAC Name]
1H-Pyrazole-3-carboxamide, 1-[(2-chloro-6-fluorophenyl)methyl]-5-(4-fluorophenyl)-N-[2-(1-methylethoxy)phenyl]- [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: 568.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 85.3±3.0 kJ/mol
Flash Point: 297.5±30.1 °C
Index of Refraction: 1.603
Molar Refractivity: 128.5±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.80
ACD/LogD (pH 5.5): 5.06
ACD/BCF (pH 5.5): 4144.09
ACD/KOC (pH 5.5): 13517.79
ACD/LogD (pH 7.4): 5.06
ACD/BCF (pH 7.4): 4143.23
ACD/KOC (pH 7.4): 13515.00
Polar Surface Area: 56 Å2
Polarizability: 50.9±0.5 10-24cm3
Surface Tension: 41.9±7.0 dyne/cm
Molar Volume: 374.0±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement