ChemSpider 2D Image | 1-(2-Pyrazinyl)-3-[6-(trifluoromethyl)-4-quinolinyl]urea | C15H10F3N5O

1-(2-Pyrazinyl)-3-[6-(trifluoromethyl)-4-quinolinyl]urea

  • Molecular FormulaC15H10F3N5O
  • Average mass333.268 Da
  • Monoisotopic mass333.083740 Da
  • ChemSpider ID24808693

More details:

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

1-(2-Pyrazinyl)-3-[6-(trifluormethyl)-4-chinolinyl]harnstoff [German] [ACD/IUPAC Name]
1-(2-Pyrazinyl)-3-[6-(trifluorométhyl)-4-quinoléinyl]urée [French] [ACD/IUPAC Name]
1-(2-Pyrazinyl)-3-[6-(trifluoromethyl)-4-quinolinyl]urea [ACD/IUPAC Name]
Urea, N-2-pyrazinyl-N'-[6-(trifluoromethyl)-4-quinolinyl]- [ACD/Index Name]
Kinome_2294

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

Density: 1.5±0.1 g/cm3
Boiling Point: 399.9±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 65.1±3.0 kJ/mol
Flash Point: 195.6±26.5 °C
Index of Refraction: 1.681
Molar Refractivity: 82.2±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.45
ACD/LogD (pH 5.5): 2.38
ACD/BCF (pH 5.5): 37.14
ACD/KOC (pH 5.5): 454.24
ACD/LogD (pH 7.4): 2.40
ACD/BCF (pH 7.4): 39.54
ACD/KOC (pH 7.4): 483.68
Polar Surface Area: 80 Å2
Polarizability: 32.6±0.5 10-24cm3
Surface Tension: 61.8±3.0 dyne/cm
Molar Volume: 217.2±3.0 cm3

Click to predict properties on the Chemicalize site


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