ChemSpider 2D Image | 3-[2-(Benzyloxy)phenyl]-5-{[5-(3-fluoro-4-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl}-1,2,4-oxadiazole | C25H19FN4O3

3-[2-(Benzyloxy)phenyl]-5-{[5-(3-fluoro-4-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl}-1,2,4-oxadiazole

  • Molecular FormulaC25H19FN4O3
  • Average mass442.442 Da
  • Monoisotopic mass442.144104 Da
  • ChemSpider ID27307619

More details:

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

1,2,4-Oxadiazole, 5-[[5-(3-fluoro-4-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl]-3-[2-(phenylmethoxy)phenyl]- [ACD/Index Name]
3-[2-(Benzyloxy)phenyl]-5-{[5-(3-fluor-4-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl}-1,2,4-oxadiazol [German] [ACD/IUPAC Name]
3-[2-(Benzyloxy)phenyl]-5-{[5-(3-fluoro-4-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl}-1,2,4-oxadiazole [ACD/IUPAC Name]
3-[2-(Benzyloxy)phényl]-5-{[5-(3-fluoro-4-méthylphényl)-1,3,4-oxadiazol-2-yl]méthyl}-1,2,4-oxadiazole [French] [ACD/IUPAC Name]
3-(2-Benzyloxy-phenyl)-5-[5-(3-fluoro-4-methyl-phenyl)-[1,3,4]oxadiazol-2-ylmethyl]-[1,2,4]oxadiazole

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

Density: 1.3±0.1 g/cm3
Boiling Point: 636.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 90.6±3.0 kJ/mol
Flash Point: 338.9±34.3 °C
Index of Refraction: 1.602
Molar Refractivity: 117.7±0.3 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.87
ACD/LogD (pH 5.5): 4.40
ACD/BCF (pH 5.5): 1302.47
ACD/KOC (pH 5.5): 5904.06
ACD/LogD (pH 7.4): 4.40
ACD/BCF (pH 7.4): 1302.47
ACD/KOC (pH 7.4): 5904.06
Polar Surface Area: 87 Å2
Polarizability: 46.7±0.5 10-24cm3
Surface Tension: 52.4±3.0 dyne/cm
Molar Volume: 343.1±3.0 cm3

Click to predict properties on the Chemicalize site


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