ChemSpider 2D Image | N-(2-{[3,5-Bis(trifluoromethyl)phenyl]amino}-2-oxoethyl)-5-(4-pyridinyl)-1H-pyrazole-3-carboxamide | C19H13F6N5O2

N-(2-{[3,5-Bis(trifluoromethyl)phenyl]amino}-2-oxoethyl)-5-(4-pyridinyl)-1H-pyrazole-3-carboxamide

  • Molecular FormulaC19H13F6N5O2
  • Average mass457.329 Da
  • Monoisotopic mass457.097351 Da
  • ChemSpider ID121299246

More details:

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

1H-Pyrazole-3-carboxamide, N-[2-[[3,5-bis(trifluoromethyl)phenyl]amino]-2-oxoethyl]-5-(4-pyridinyl)- [ACD/Index Name]
N-(2-{[3,5-Bis(trifluormethyl)phenyl]amino}-2-oxoethyl)-5-(4-pyridinyl)-1H-pyrazol-3-carboxamid [German] [ACD/IUPAC Name]
N-(2-{[3,5-Bis(trifluoromethyl)phenyl]amino}-2-oxoethyl)-5-(4-pyridinyl)-1H-pyrazole-3-carboxamide [ACD/IUPAC Name]
N-(2-{[3,5-Bis(trifluorométhyl)phényl]amino}-2-oxoéthyl)-5-(4-pyridinyl)-1H-pyrazole-3-carboxamide [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 637.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 94.1±3.0 kJ/mol
Flash Point: 339.0±31.5 °C
Index of Refraction: 1.563
Molar Refractivity: 98.9±0.3 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.47
ACD/LogD (pH 5.5): 2.34
ACD/BCF (pH 5.5): 30.62
ACD/KOC (pH 5.5): 341.44
ACD/LogD (pH 7.4): 2.58
ACD/BCF (pH 7.4): 53.54
ACD/KOC (pH 7.4): 597.02
Polar Surface Area: 100 Å2
Polarizability: 39.2±0.5 10-24cm3
Surface Tension: 46.6±3.0 dyne/cm
Molar Volume: 304.3±3.0 cm3

Click to predict properties on the Chemicalize site


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