ChemSpider 2D Image | N-(3-{4-[4-Fluoro-2-(pentafluoroethoxy)phenyl]-1-piperazinyl}propyl)-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide | C26H26F6N4O3

N-(3-{4-[4-Fluoro-2-(pentafluoroethoxy)phenyl]-1-piperazinyl}propyl)-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide

  • Molecular FormulaC26H26F6N4O3
  • Average mass556.500 Da
  • Monoisotopic mass556.190918 Da
  • ChemSpider ID8004891

More details:

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

4-Isoxazolecarboxamide, N-[3-[4-[4-fluoro-2-(1,1,2,2,2-pentafluoroethoxy)phenyl]-1-piperazinyl]propyl]-5-methyl-3-phenyl- [ACD/Index Name]
N-(3-{4-[4-Fluor-2-(pentafluorethoxy)phenyl]-1-piperazinyl}propyl)-5-methyl-3-phenyl-1,2-oxazol-4-carboxamid [German] [ACD/IUPAC Name]
N-(3-{4-[4-Fluoro-2-(pentafluoroethoxy)phenyl]-1-piperazinyl}propyl)-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide [ACD/IUPAC Name]
N-(3-{4-[4-Fluoro-2-(pentafluoroéthoxy)phényl]-1-pipérazinyl}propyl)-5-méthyl-3-phényl-1,2-oxazole-4-carboxamide [French] [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: 608.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 90.4±3.0 kJ/mol
Flash Point: 321.6±31.5 °C
Index of Refraction: 1.525
Molar Refractivity: 129.0±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 5.36
ACD/LogD (pH 5.5): 3.20
ACD/BCF (pH 5.5): 71.26
ACD/KOC (pH 5.5): 286.20
ACD/LogD (pH 7.4): 4.51
ACD/BCF (pH 7.4): 1479.59
ACD/KOC (pH 7.4): 5942.54
Polar Surface Area: 71 Å2
Polarizability: 51.2±0.5 10-24cm3
Surface Tension: 40.1±3.0 dyne/cm
Molar Volume: 421.2±3.0 cm3

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