ChemSpider 2D Image | 1-(3-Fluoro-4-methylphenyl)-3-[6-(4-methyl-1-piperazinyl)-4-pyrimidinyl]urea | C17H21FN6O

1-(3-Fluoro-4-methylphenyl)-3-[6-(4-methyl-1-piperazinyl)-4-pyrimidinyl]urea

  • Molecular FormulaC17H21FN6O
  • Average mass344.387 Da
  • Monoisotopic mass344.176086 Da
  • ChemSpider ID30676608

More details:

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

1-(3-Fluor-4-methylphenyl)-3-[6-(4-methyl-1-piperazinyl)-4-pyrimidinyl]harnstoff [German] [ACD/IUPAC Name]
1-(3-Fluoro-4-methylphenyl)-3-[6-(4-methyl-1-piperazinyl)-4-pyrimidinyl]urea [ACD/IUPAC Name]
1-(3-Fluoro-4-méthylphényl)-3-[6-(4-méthyl-1-pipérazinyl)-4-pyrimidinyl]urée [French] [ACD/IUPAC Name]
Urea, N-(3-fluoro-4-methylphenyl)-N'-[6-(4-methyl-1-piperazinyl)-4-pyrimidinyl]- [ACD/Index Name]
1-(3-fluoro-4-methylphenyl)-3-(6-(4-methylpiperazin-1-yl)pyrimidin-4-yl)urea
1-(3-fluoro-4-methylphenyl)-3-[6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]urea
1396855-67-6 [RN]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 432.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.8±3.0 kJ/mol
Flash Point: 215.5±28.7 °C
Index of Refraction: 1.647
Molar Refractivity: 94.6±0.3 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.14
ACD/LogD (pH 5.5): 1.04
ACD/BCF (pH 5.5): 1.46
ACD/KOC (pH 5.5): 15.25
ACD/LogD (pH 7.4): 2.56
ACD/BCF (pH 7.4): 47.21
ACD/KOC (pH 7.4): 494.56
Polar Surface Area: 73 Å2
Polarizability: 37.5±0.5 10-24cm3
Surface Tension: 64.7±3.0 dyne/cm
Molar Volume: 260.1±3.0 cm3

Click to predict properties on the Chemicalize site


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