ChemSpider 2D Image | 4-(4-Methyl-1-piperazinyl)-3-(5-phenyl-1,3,4-oxadiazol-2-yl)-7-(trifluoromethyl)quinoline | C23H20F3N5O

4-(4-Methyl-1-piperazinyl)-3-(5-phenyl-1,3,4-oxadiazol-2-yl)-7-(trifluoromethyl)quinoline

  • Molecular FormulaC23H20F3N5O
  • Average mass439.433 Da
  • Monoisotopic mass439.161987 Da
  • ChemSpider ID30657124

More details:

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

4-(4-Methyl-1-piperazinyl)-3-(5-phenyl-1,3,4-oxadiazol-2-yl)-7-(trifluormethyl)chinolin [German] [ACD/IUPAC Name]
4-(4-Méthyl-1-pipérazinyl)-3-(5-phényl-1,3,4-oxadiazol-2-yl)-7-(trifluorométhyl)quinoléine [French] [ACD/IUPAC Name]
4-(4-Methyl-1-piperazinyl)-3-(5-phenyl-1,3,4-oxadiazol-2-yl)-7-(trifluoromethyl)quinoline [ACD/IUPAC Name]
Quinoline, 4-(4-methyl-1-piperazinyl)-3-(5-phenyl-1,3,4-oxadiazol-2-yl)-7-(trifluoromethyl)- [ACD/Index 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: 582.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.1±3.0 kJ/mol
Flash Point: 306.0±32.9 °C
Index of Refraction: 1.595
Molar Refractivity: 113.3±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.95
ACD/LogD (pH 5.5): 3.04
ACD/BCF (pH 5.5): 75.25
ACD/KOC (pH 5.5): 441.30
ACD/LogD (pH 7.4): 3.86
ACD/BCF (pH 7.4): 495.62
ACD/KOC (pH 7.4): 2906.44
Polar Surface Area: 58 Å2
Polarizability: 44.9±0.5 10-24cm3
Surface Tension: 48.5±3.0 dyne/cm
Molar Volume: 333.4±3.0 cm3

Click to predict properties on the Chemicalize site


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