ChemSpider 2D Image | N-{[3-(4-Chlorophenyl)-1-phenyl-1H-pyrazol-4-yl]methyl}-N-methyl-6-quinoxalinecarboxamide | C26H20ClN5O

N-{[3-(4-Chlorophenyl)-1-phenyl-1H-pyrazol-4-yl]methyl}-N-methyl-6-quinoxalinecarboxamide

  • Molecular FormulaC26H20ClN5O
  • Average mass453.923 Da
  • Monoisotopic mass453.135651 Da
  • ChemSpider ID22767643

More details:

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

6-Quinoxalinecarboxamide, N-[[3-(4-chlorophenyl)-1-phenyl-1H-pyrazol-4-yl]methyl]-N-methyl- [ACD/Index Name]
N-{[3-(4-Chlorophenyl)-1-phenyl-1H-pyrazol-4-yl]methyl}-N-methyl-6-quinoxalinecarboxamide [ACD/IUPAC Name]
N-{[3-(4-Chlorophényl)-1-phényl-1H-pyrazol-4-yl]méthyl}-N-méthyl-6-quinoxalinecarboxamide [French] [ACD/IUPAC Name]
N-{[3-(4-Chlorphenyl)-1-phenyl-1H-pyrazol-4-yl]methyl}-N-methyl-6-chinoxalincarboxamid [German] [ACD/IUPAC Name]
N-{[3-(4-CHLOROPHENYL)-1-PHENYL-1H-PYRAZOL-4-YL]METHYL}-N-METHYLQUINOXALINE-6-CARBOXAMIDE
N-{[3-(4-CHLOROPHENYL)-1-PHENYLPYRAZOL-4-YL]METHYL}-N-METHYLQUINOXALINE-6-CARBOXAMIDE

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

Density: 1.3±0.1 g/cm3
Boiling Point: 690.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 101.2±3.0 kJ/mol
Flash Point: 371.5±31.5 °C
Index of Refraction: 1.679
Molar Refractivity: 132.0±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.96
ACD/LogD (pH 5.5): 4.12
ACD/BCF (pH 5.5): 791.66
ACD/KOC (pH 5.5): 4134.04
ACD/LogD (pH 7.4): 4.12
ACD/BCF (pH 7.4): 791.66
ACD/KOC (pH 7.4): 4134.05
Polar Surface Area: 64 Å2
Polarizability: 52.3±0.5 10-24cm3
Surface Tension: 52.0±7.0 dyne/cm
Molar Volume: 349.6±7.0 cm3

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