ChemSpider 2D Image | (1-{[5-(2,4-Dichlorophenyl)-1,3,4-oxadiazol-2-yl]methyl}-4-piperidinyl)(2,5-difluorophenyl)methanone | C21H17Cl2F2N3O2

(1-{[5-(2,4-Dichlorophenyl)-1,3,4-oxadiazol-2-yl]methyl}-4-piperidinyl)(2,5-difluorophenyl)methanone

  • Molecular FormulaC21H17Cl2F2N3O2
  • Average mass452.281 Da
  • Monoisotopic mass451.066589 Da
  • ChemSpider ID78460799

More details:

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

(1-{[5-(2,4-Dichlorophenyl)-1,3,4-oxadiazol-2-yl]methyl}-4-piperidinyl)(2,5-difluorophenyl)methanone [ACD/IUPAC Name]
(1-{[5-(2,4-Dichlorophényl)-1,3,4-oxadiazol-2-yl]méthyl}-4-pipéridinyl)(2,5-difluorophényl)méthanone [French] [ACD/IUPAC Name]
(1-{[5-(2,4-Dichlorphenyl)-1,3,4-oxadiazol-2-yl]methyl}-4-piperidinyl)(2,5-difluorphenyl)methanon [German] [ACD/IUPAC Name]
Methanone, [1-[[5-(2,4-dichlorophenyl)-1,3,4-oxadiazol-2-yl]methyl]-4-piperidinyl](2,5-difluorophenyl)- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 565.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.9±3.0 kJ/mol
Flash Point: 295.7±32.9 °C
Index of Refraction: 1.593
Molar Refractivity: 108.3±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.44
ACD/LogD (pH 5.5): 3.88
ACD/BCF (pH 5.5): 507.13
ACD/KOC (pH 5.5): 2901.19
ACD/LogD (pH 7.4): 3.93
ACD/BCF (pH 7.4): 573.32
ACD/KOC (pH 7.4): 3279.88
Polar Surface Area: 59 Å2
Polarizability: 42.9±0.5 10-24cm3
Surface Tension: 53.7±3.0 dyne/cm
Molar Volume: 319.7±3.0 cm3

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