ChemSpider 2D Image | 6-{2-[3-(2-Fluorophenyl)-1,2,4-oxadiazol-5-yl]ethyl}-3-isopropyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole | C16H15FN6OS

6-{2-[3-(2-Fluorophenyl)-1,2,4-oxadiazol-5-yl]ethyl}-3-isopropyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

  • Molecular FormulaC16H15FN6OS
  • Average mass358.393 Da
  • Monoisotopic mass358.101196 Da
  • ChemSpider ID29577941

More details:

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

1,2,4-Triazolo[3,4-b][1,3,4]thiadiazole, 6-[2-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]ethyl]-3-(1-methylethyl)- [ACD/Index Name]
6-{2-[3-(2-Fluorophenyl)-1,2,4-oxadiazol-5-yl]ethyl}-3-isopropyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole [ACD/IUPAC Name]
6-{2-[3-(2-Fluorophényl)-1,2,4-oxadiazol-5-yl]éthyl}-3-isopropyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole [French] [ACD/IUPAC Name]
6-{2-[3-(2-Fluorphenyl)-1,2,4-oxadiazol-5-yl]ethyl}-3-isopropyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol [German] [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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.742
Molar Refractivity: 94.0±0.5 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.40
ACD/LogD (pH 5.5): 2.92
ACD/BCF (pH 5.5): 98.09
ACD/KOC (pH 5.5): 927.30
ACD/LogD (pH 7.4): 2.92
ACD/BCF (pH 7.4): 98.09
ACD/KOC (pH 7.4): 927.31
Polar Surface Area: 110 Å2
Polarizability: 37.3±0.5 10-24cm3
Surface Tension: 57.2±7.0 dyne/cm
Molar Volume: 232.6±7.0 cm3

Click to predict properties on the Chemicalize site


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