ChemSpider 2D Image | N-{[5-(2,4-Difluorophenoxy)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}-3-fluoro-N-isopropylbenzamide | C27H24F3N3O2

N-{[5-(2,4-Difluorophenoxy)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}-3-fluoro-N-isopropylbenzamide

  • Molecular FormulaC27H24F3N3O2
  • Average mass479.494 Da
  • Monoisotopic mass479.182068 Da
  • ChemSpider ID22615829

More details:

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

Benzamide, N-[[5-(2,4-difluorophenoxy)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl]-3-fluoro-N-(1-methylethyl)- [ACD/Index Name]
N-{[5-(2,4-Difluorophenoxy)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}-3-fluoro-N-isopropylbenzamide [ACD/IUPAC Name]
N-{[5-(2,4-Difluorophénoxy)-3-méthyl-1-phényl-1H-pyrazol-4-yl]méthyl}-3-fluoro-N-isopropylbenzamide [French] [ACD/IUPAC Name]
N-{[5-(2,4-Difluorphenoxy)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}-3-fluor-N-isopropylbenzamid [German] [ACD/IUPAC 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: 575.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 86.2±3.0 kJ/mol
Flash Point: 301.8±30.1 °C
Index of Refraction: 1.578
Molar Refractivity: 129.1±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 6.33
ACD/LogD (pH 5.5): 5.57
ACD/BCF (pH 5.5): 9984.28
ACD/KOC (pH 5.5): 25368.79
ACD/LogD (pH 7.4): 5.57
ACD/BCF (pH 7.4): 9984.34
ACD/KOC (pH 7.4): 25368.93
Polar Surface Area: 47 Å2
Polarizability: 51.2±0.5 10-24cm3
Surface Tension: 38.5±7.0 dyne/cm
Molar Volume: 388.8±7.0 cm3

Click to predict properties on the Chemicalize site


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