ChemSpider 2D Image | 1-(2,6-Difluorophenyl)-1-(9-methyl-2-phenyl-9H-purin-6-yl)urea | C19H14F2N6O

1-(2,6-Difluorophenyl)-1-(9-methyl-2-phenyl-9H-purin-6-yl)urea

  • Molecular FormulaC19H14F2N6O
  • Average mass380.351 Da
  • Monoisotopic mass380.119720 Da
  • ChemSpider ID23116413

More details:

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

1-(2,6-Difluorophenyl)-1-(9-methyl-2-phenyl-9H-purin-6-yl)urea [ACD/IUPAC Name]
1-(2,6-Difluorophényl)-1-(9-méthyl-2-phényl-9H-purin-6-yl)urée [French] [ACD/IUPAC Name]
1-(2,6-Difluorphenyl)-1-(9-methyl-2-phenyl-9H-purin-6-yl)harnstoff [German] [ACD/IUPAC Name]
Urea, N-(2,6-difluorophenyl)-N-(9-methyl-2-phenyl-9H-purin-6-yl)- [ACD/Index Name]
1-(2,6-Difluoro-phenyl)-1-(9-methyl-2-phenyl-9H-purin-6-yl)-urea
CHEMBL18617

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

Density: 1.5±0.1 g/cm3
Boiling Point: 461.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 72.2±3.0 kJ/mol
Flash Point: 232.7±31.5 °C
Index of Refraction: 1.693
Molar Refractivity: 99.3±0.5 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.38
ACD/LogD (pH 5.5): 2.40
ACD/BCF (pH 5.5): 39.27
ACD/KOC (pH 5.5): 481.52
ACD/LogD (pH 7.4): 2.40
ACD/BCF (pH 7.4): 39.24
ACD/KOC (pH 7.4): 481.17
Polar Surface Area: 90 Å2
Polarizability: 39.4±0.5 10-24cm3
Surface Tension: 54.0±7.0 dyne/cm
Molar Volume: 259.0±7.0 cm3

Click to predict properties on the Chemicalize site


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