ChemSpider 2D Image | 4-Chloro-1-(4-fluorobenzyl)-5-(4-fluorophenyl)-N-[1-(4-methoxyphenyl)ethyl]-1H-pyrazole-3-carboxamide | C26H22ClF2N3O2

4-Chloro-1-(4-fluorobenzyl)-5-(4-fluorophenyl)-N-[1-(4-methoxyphenyl)ethyl]-1H-pyrazole-3-carboxamide

  • Molecular FormulaC26H22ClF2N3O2
  • Average mass481.922 Da
  • Monoisotopic mass481.136871 Da
  • ChemSpider ID67463154

More details:

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

1H-Pyrazole-3-carboxamide, 4-chloro-5-(4-fluorophenyl)-1-[(4-fluorophenyl)methyl]-N-[1-(4-methoxyphenyl)ethyl]- [ACD/Index Name]
4-Chlor-1-(4-fluorbenzyl)-5-(4-fluorphenyl)-N-[1-(4-methoxyphenyl)ethyl]-1H-pyrazol-3-carboxamid [German] [ACD/IUPAC Name]
4-Chloro-1-(4-fluorobenzyl)-5-(4-fluorophenyl)-N-[1-(4-methoxyphenyl)ethyl]-1H-pyrazole-3-carboxamide [ACD/IUPAC Name]
4-Chloro-1-(4-fluorobenzyl)-5-(4-fluorophényl)-N-[1-(4-méthoxyphényl)éthyl]-1H-pyrazole-3-carboxamide [French] [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: 623.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 92.4±3.0 kJ/mol
Flash Point: 331.1±31.5 °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: 4.87
ACD/LogD (pH 5.5): 5.15
ACD/BCF (pH 5.5): 4822.30
ACD/KOC (pH 5.5): 15068.14
ACD/LogD (pH 7.4): 5.15
ACD/BCF (pH 7.4): 4801.64
ACD/KOC (pH 7.4): 15003.59
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

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