ChemSpider 2D Image | 1-(6-Cyano-2-pyridinyl)-3-[7-(trifluoromethyl)-4-quinolinyl]urea | C17H10F3N5O

1-(6-Cyano-2-pyridinyl)-3-[7-(trifluoromethyl)-4-quinolinyl]urea

  • Molecular FormulaC17H10F3N5O
  • Average mass357.289 Da
  • Monoisotopic mass357.083740 Da
  • ChemSpider ID24808706

More details:

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

1-(6-Cyan-2-pyridinyl)-3-[7-(trifluormethyl)-4-chinolinyl]harnstoff [German] [ACD/IUPAC Name]
1-(6-Cyano-2-pyridinyl)-3-[7-(trifluorométhyl)-4-quinoléinyl]urée [French] [ACD/IUPAC Name]
1-(6-Cyano-2-pyridinyl)-3-[7-(trifluoromethyl)-4-quinolinyl]urea [ACD/IUPAC Name]
Urea, N-(6-cyano-2-pyridinyl)-N'-[7-(trifluoromethyl)-4-quinolinyl]- [ACD/Index Name]
Kinome_2273

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

Density: 1.5±0.1 g/cm3
Boiling Point: 443.1±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.1±3.0 kJ/mol
Flash Point: 221.8±28.7 °C
Index of Refraction: 1.640
Molar Refractivity: 86.2±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.75
ACD/LogD (pH 5.5): 2.98
ACD/BCF (pH 5.5): 109.05
ACD/KOC (pH 5.5): 999.14
ACD/LogD (pH 7.4): 2.99
ACD/BCF (pH 7.4): 109.46
ACD/KOC (pH 7.4): 1002.90
Polar Surface Area: 91 Å2
Polarizability: 34.2±0.5 10-24cm3
Surface Tension: 67.2±5.0 dyne/cm
Molar Volume: 239.2±5.0 cm3

Click to predict properties on the Chemicalize site


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