ChemSpider 2D Image | N-Butyl-N-ethyl-2-{8-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-3-oxo[1,2,4]triazolo[4,3-a]pyridin-2(3H)-yl}acetamide | C22H23FN6O3

N-Butyl-N-ethyl-2-{8-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-3-oxo[1,2,4]triazolo[4,3-a]pyridin-2(3H)-yl}acetamide

  • Molecular FormulaC22H23FN6O3
  • Average mass438.455 Da
  • Monoisotopic mass438.181580 Da
  • ChemSpider ID26020049

More details:

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

1,2,4-Triazolo[4,3-a]pyridine-2(3H)-acetamide, N-butyl-N-ethyl-8-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-3-oxo- [ACD/Index Name]
N-Butyl-N-ethyl-2-{8-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-3-oxo[1,2,4]triazolo[4,3-a]pyridin-2(3H)-yl}acetamide [ACD/IUPAC Name]
N-Butyl-N-éthyl-2-{8-[3-(3-fluorophényl)-1,2,4-oxadiazol-5-yl]-3-oxo[1,2,4]triazolo[4,3-a]pyridin-2(3H)-yl}acétamide [French] [ACD/IUPAC Name]
N-Butyl-N-ethyl-2-{8-[3-(3-fluorphenyl)-1,2,4-oxadiazol-5-yl]-3-oxo[1,2,4]triazolo[4,3-a]pyridin-2(3H)-yl}acetamid [German] [ACD/IUPAC Name]
N-Butyl-N-ethyl-2-{8-[3-(3-fluoro-phenyl)-[1,2,4]oxadiazol-5-yl]-3-oxo-[1,2,4]triazolo[4,3-a]pyridin-2-yl}-acetamide

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

Density: 1.4±0.1 g/cm3
Boiling Point: 602.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 89.7±3.0 kJ/mol
Flash Point: 318.4±34.3 °C
Index of Refraction: 1.652
Molar Refractivity: 117.4±0.5 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 2.21
ACD/LogD (pH 5.5): 2.50
ACD/BCF (pH 5.5): 46.80
ACD/KOC (pH 5.5): 545.94
ACD/LogD (pH 7.4): 2.50
ACD/BCF (pH 7.4): 46.80
ACD/KOC (pH 7.4): 545.95
Polar Surface Area: 95 Å2
Polarizability: 46.5±0.5 10-24cm3
Surface Tension: 51.9±7.0 dyne/cm
Molar Volume: 321.1±7.0 cm3

Click to predict properties on the Chemicalize site


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