ChemSpider 2D Image | 3-[3-(4-Chlorophenyl)-1,2,4-oxadiazol-5-yl]-1-[4-(3-fluoro-4-methoxybenzyl)-1-piperazinyl]-1-propanone | C23H24ClFN4O3

3-[3-(4-Chlorophenyl)-1,2,4-oxadiazol-5-yl]-1-[4-(3-fluoro-4-methoxybenzyl)-1-piperazinyl]-1-propanone

  • Molecular FormulaC23H24ClFN4O3
  • Average mass458.913 Da
  • Monoisotopic mass458.152100 Da
  • ChemSpider ID21967035

More details:

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

1-Propanone, 3-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-1-[4-[(3-fluoro-4-methoxyphenyl)methyl]-1-piperazinyl]- [ACD/Index Name]
3-[3-(4-Chlorophenyl)-1,2,4-oxadiazol-5-yl]-1-[4-(3-fluoro-4-methoxybenzyl)-1-piperazinyl]-1-propanone [ACD/IUPAC Name]
3-[3-(4-Chlorophényl)-1,2,4-oxadiazol-5-yl]-1-[4-(3-fluoro-4-méthoxybenzyl)-1-pipérazinyl]-1-propanone [French] [ACD/IUPAC Name]
3-[3-(4-Chlorphenyl)-1,2,4-oxadiazol-5-yl]-1-[4-(3-fluor-4-methoxybenzyl)-1-piperazinyl]-1-propanon [German] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 623.2±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 92.3±3.0 kJ/mol
Flash Point: 330.7±34.3 °C
Index of Refraction: 1.587
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: 4.21
ACD/LogD (pH 5.5): 3.03
ACD/BCF (pH 5.5): 101.34
ACD/KOC (pH 5.5): 794.70
ACD/LogD (pH 7.4): 3.29
ACD/BCF (pH 7.4): 187.31
ACD/KOC (pH 7.4): 1468.79
Polar Surface Area: 72 Å2
Polarizability: 46.7±0.5 10-24cm3
Surface Tension: 53.8±3.0 dyne/cm
Molar Volume: 350.0±3.0 cm3

Click to predict properties on the Chemicalize site


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