ChemSpider 2D Image | 1-{3-Fluoro-4-[7-(4-methyl-1H-imidazol-2-yl)-1-oxo-2,3-dihydro-1H-isoindol-4-yl]phenyl}-3-(2,4,6-trifluorophenyl)urea | C25H17F4N5O2

1-{3-Fluoro-4-[7-(4-methyl-1H-imidazol-2-yl)-1-oxo-2,3-dihydro-1H-isoindol-4-yl]phenyl}-3-(2,4,6-trifluorophenyl)urea

  • Molecular FormulaC25H17F4N5O2
  • Average mass495.428 Da
  • Monoisotopic mass495.131836 Da
  • ChemSpider ID81367387

More details:






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

1-{3-Fluor-4-[7-(4-methyl-1H-imidazol-2-yl)-1-oxo-2,3-dihydro-1H-isoindol-4-yl]phenyl}-3-(2,4,6-trifluorphenyl)harnstoff [German] [ACD/IUPAC Name]
1-{3-Fluoro-4-[7-(4-methyl-1H-imidazol-2-yl)-1-oxo-2,3-dihydro-1H-isoindol-4-yl]phenyl}-3-(2,4,6-trifluorophenyl)urea [ACD/IUPAC Name]
1-{3-Fluoro-4-[7-(4-méthyl-1H-imidazol-2-yl)-1-oxo-2,3-dihydro-1H-isoindol-4-yl]phényl}-3-(2,4,6-trifluorophényl)urée [French] [ACD/IUPAC Name]
Urea, N-[4-[2,3-dihydro-7-(4-methyl-1H-imidazol-2-yl)-1-oxo-1H-isoindol-4-yl]-3-fluorophenyl]-N'-(2,4,6-trifluorophenyl)- [ACD/Index Name]
1616428-23-9 [RN]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.5±0.1 g/cm3
Boiling Point: 663.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 97.6±3.0 kJ/mol
Flash Point: 355.3±31.5 °C
Index of Refraction: 1.674
Molar Refractivity: 122.6±0.3 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.44
ACD/LogD (pH 5.5): 4.25
ACD/BCF (pH 5.5): 993.21
ACD/KOC (pH 5.5): 4856.81
ACD/LogD (pH 7.4): 4.24
ACD/BCF (pH 7.4): 987.11
ACD/KOC (pH 7.4): 4826.96
Polar Surface Area: 99 Å2
Polarizability: 48.6±0.5 10-24cm3
Surface Tension: 65.2±3.0 dyne/cm
Molar Volume: 326.7±3.0 cm3

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