ChemSpider 2D Image | 1-(7,8-Dichloro-4-quinolinyl)-3-[6-(trifluoromethyl)-2-pyridinyl]urea | C16H9Cl2F3N4O

1-(7,8-Dichloro-4-quinolinyl)-3-[6-(trifluoromethyl)-2-pyridinyl]urea

  • Molecular FormulaC16H9Cl2F3N4O
  • Average mass401.170 Da
  • Monoisotopic mass400.010559 Da
  • ChemSpider ID24808694

More details:

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

1-(7,8-Dichlor-4-chinolinyl)-3-[6-(trifluormethyl)-2-pyridinyl]harnstoff [German] [ACD/IUPAC Name]
1-(7,8-Dichloro-4-quinoléinyl)-3-[6-(trifluorométhyl)-2-pyridinyl]urée [French] [ACD/IUPAC Name]
1-(7,8-Dichloro-4-quinolinyl)-3-[6-(trifluoromethyl)-2-pyridinyl]urea [ACD/IUPAC Name]
Urea, N-(7,8-dichloro-4-quinolinyl)-N'-[6-(trifluoromethyl)-2-pyridinyl]- [ACD/Index Name]
Kinome_2290

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

Density: 1.6±0.1 g/cm3
Boiling Point: 433.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 69.0±3.0 kJ/mol
Flash Point: 216.0±28.7 °C
Index of Refraction: 1.682
Molar Refractivity: 93.9±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.51
ACD/LogD (pH 5.5): 4.24
ACD/BCF (pH 5.5): 979.83
ACD/KOC (pH 5.5): 4815.64
ACD/LogD (pH 7.4): 4.24
ACD/BCF (pH 7.4): 979.07
ACD/KOC (pH 7.4): 4811.91
Polar Surface Area: 67 Å2
Polarizability: 37.2±0.5 10-24cm3
Surface Tension: 58.9±3.0 dyne/cm
Molar Volume: 247.8±3.0 cm3

Click to predict properties on the Chemicalize site


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