ChemSpider 2D Image | 5-Ethyl-N-(3-fluorophenyl)-1-(3-phenyl-2,1-benzoxazol-5-yl)-1H-1,2,3-triazole-4-carboxamide | C24H18FN5O2

5-Ethyl-N-(3-fluorophenyl)-1-(3-phenyl-2,1-benzoxazol-5-yl)-1H-1,2,3-triazole-4-carboxamide

  • Molecular FormulaC24H18FN5O2
  • Average mass427.430 Da
  • Monoisotopic mass427.144440 Da
  • ChemSpider ID23379935

More details:

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

1H-1,2,3-Triazole-4-carboxamide, 5-ethyl-N-(3-fluorophenyl)-1-(3-phenyl-2,1-benzisoxazol-5-yl)- [ACD/Index Name]
5-Ethyl-N-(3-fluorophenyl)-1-(3-phenyl-2,1-benzoxazol-5-yl)-1H-1,2,3-triazole-4-carboxamide [ACD/IUPAC Name]
5-Éthyl-N-(3-fluorophényl)-1-(3-phényl-2,1-benzoxazol-5-yl)-1H-1,2,3-triazole-4-carboxamide [French] [ACD/IUPAC Name]
5-Ethyl-N-(3-fluorphenyl)-1-(3-phenyl-2,1-benzoxazol-5-yl)-1H-1,2,3-triazol-4-carboxamid [German] [ACD/IUPAC Name]
5-Ethyl-1-(3-phenyl-benzo[c]isoxazol-5-yl)-1H-[1,2,3]triazole-4-carboxylic acid (3-fluoro-phenyl)-amide

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.686
Molar Refractivity: 118.5±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.74
ACD/LogD (pH 5.5): 4.06
ACD/BCF (pH 5.5): 719.43
ACD/KOC (pH 5.5): 3860.40
ACD/LogD (pH 7.4): 4.06
ACD/BCF (pH 7.4): 718.04
ACD/KOC (pH 7.4): 3852.90
Polar Surface Area: 86 Å2
Polarizability: 47.0±0.5 10-24cm3
Surface Tension: 52.3±7.0 dyne/cm
Molar Volume: 311.5±7.0 cm3

Click to predict properties on the Chemicalize site


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