ChemSpider 2D Image | N-{[3-(4-Fluorophenyl)-1H-pyrazol-4-yl]methyl}-N-methyl-2-(4H-1,2,4-triazol-4-yl)isonicotinamide | C19H16FN7O

N-{[3-(4-Fluorophenyl)-1H-pyrazol-4-yl]methyl}-N-methyl-2-(4H-1,2,4-triazol-4-yl)isonicotinamide

  • Molecular FormulaC19H16FN7O
  • Average mass377.375 Da
  • Monoisotopic mass377.140045 Da
  • ChemSpider ID30928213

More details:

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

4-Pyridinecarboxamide, N-[[3-(4-fluorophenyl)-1H-pyrazol-4-yl]methyl]-N-methyl-2-(4H-1,2,4-triazol-4-yl)- [ACD/Index Name]
N-{[3-(4-Fluorophenyl)-1H-pyrazol-4-yl]methyl}-N-methyl-2-(4H-1,2,4-triazol-4-yl)isonicotinamide [ACD/IUPAC Name]
N-{[3-(4-Fluorophényl)-1H-pyrazol-4-yl]méthyl}-N-méthyl-2-(4H-1,2,4-triazol-4-yl)isonicotinamide [French] [ACD/IUPAC Name]
N-{[3-(4-Fluorphenyl)-1H-pyrazol-4-yl]methyl}-N-methyl-2-(4H-1,2,4-triazol-4-yl)isonicotinamid [German] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 732.4±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 106.9±3.0 kJ/mol
Flash Point: 396.7±35.7 °C
Index of Refraction: 1.698
Molar Refractivity: 103.6±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 0.00
ACD/LogD (pH 5.5): 1.03
ACD/BCF (pH 5.5): 3.61
ACD/KOC (pH 5.5): 87.13
ACD/LogD (pH 7.4): 1.04
ACD/BCF (pH 7.4): 3.61
ACD/KOC (pH 7.4): 87.17
Polar Surface Area: 93 Å2
Polarizability: 41.1±0.5 10-24cm3
Surface Tension: 55.7±7.0 dyne/cm
Molar Volume: 268.7±7.0 cm3

Click to predict properties on the Chemicalize site


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