ChemSpider 2D Image | 1-(3-{[6-(4-Fluorophenyl)-2-pyrazinyl]oxy}phenyl)-3-[3-(trifluoromethyl)phenyl]urea | C24H16F4N4O2

1-(3-{[6-(4-Fluorophenyl)-2-pyrazinyl]oxy}phenyl)-3-[3-(trifluoromethyl)phenyl]urea

  • Molecular FormulaC24H16F4N4O2
  • Average mass468.403 Da
  • Monoisotopic mass468.120941 Da
  • ChemSpider ID58975163

More details:

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

1-(3-{[6-(4-Fluorophenyl)-2-pyrazinyl]oxy}phenyl)-3-[3-(trifluoromethyl)phenyl]urea [ACD/IUPAC Name]
1-(3-{[6-(4-Fluorophényl)-2-pyrazinyl]oxy}phényl)-3-[3-(trifluorométhyl)phényl]urée [French] [ACD/IUPAC Name]
1-(3-{[6-(4-Fluorphenyl)-2-pyrazinyl]oxy}phenyl)-3-[3-(trifluormethyl)phenyl]harnstoff [German] [ACD/IUPAC Name]
Urea, N-[3-[[6-(4-fluorophenyl)-2-pyrazinyl]oxy]phenyl]-N'-[3-(trifluoromethyl)phenyl]- [ACD/Index 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: 495.8±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.3±3.0 kJ/mol
Flash Point: 253.6±28.7 °C
Index of Refraction: 1.629
Molar Refractivity: 117.3±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 6.17
ACD/LogD (pH 5.5): 5.24
ACD/BCF (pH 5.5): 5675.41
ACD/KOC (pH 5.5): 16931.81
ACD/LogD (pH 7.4): 5.24
ACD/BCF (pH 7.4): 5675.14
ACD/KOC (pH 7.4): 16931.00
Polar Surface Area: 76 Å2
Polarizability: 46.5±0.5 10-24cm3
Surface Tension: 51.2±3.0 dyne/cm
Molar Volume: 329.9±3.0 cm3

Click to predict properties on the Chemicalize site


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