ChemSpider 2D Image | 3-[(3-Chloro-4-methyl-2-quinolinyl)methyl]-5-(4-fluorophenyl)-1,3,4-oxadiazol-2(3H)-one | C19H13ClFN3O2

3-[(3-Chloro-4-methyl-2-quinolinyl)methyl]-5-(4-fluorophenyl)-1,3,4-oxadiazol-2(3H)-one

  • Molecular FormulaC19H13ClFN3O2
  • Average mass369.777 Da
  • Monoisotopic mass369.068024 Da
  • ChemSpider ID22099251

More details:

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

1,3,4-Oxadiazol-2(3H)-one, 3-[(3-chloro-4-methyl-2-quinolinyl)methyl]-5-(4-fluorophenyl)- [ACD/Index Name]
3-[(3-Chlor-4-methyl-2-chinolinyl)methyl]-5-(4-fluorphenyl)-1,3,4-oxadiazol-2(3H)-on [German] [ACD/IUPAC Name]
3-[(3-Chloro-4-méthyl-2-quinoléinyl)méthyl]-5-(4-fluorophényl)-1,3,4-oxadiazol-2(3H)-one [French] [ACD/IUPAC Name]
3-[(3-Chloro-4-methyl-2-quinolinyl)methyl]-5-(4-fluorophenyl)-1,3,4-oxadiazol-2(3H)-one [ACD/IUPAC 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: 477.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.2±3.0 kJ/mol
Flash Point: 242.8±31.5 °C
Index of Refraction: 1.666
Molar Refractivity: 96.5±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.36
ACD/LogD (pH 5.5): 3.73
ACD/BCF (pH 5.5): 405.93
ACD/KOC (pH 5.5): 2562.33
ACD/LogD (pH 7.4): 3.73
ACD/BCF (pH 7.4): 406.24
ACD/KOC (pH 7.4): 2564.32
Polar Surface Area: 55 Å2
Polarizability: 38.3±0.5 10-24cm3
Surface Tension: 49.5±7.0 dyne/cm
Molar Volume: 259.6±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement