ChemSpider 2D Image | 4-(3-Bromo-4-fluorophenyl)-N,N-diethyl-6-methyl-1-(4-methylphenyl)-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxamide | C23H25BrFN3O2

4-(3-Bromo-4-fluorophenyl)-N,N-diethyl-6-methyl-1-(4-methylphenyl)-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxamide

  • Molecular FormulaC23H25BrFN3O2
  • Average mass474.366 Da
  • Monoisotopic mass473.111420 Da
  • ChemSpider ID22463687

More details:

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

4-(3-Brom-4-fluorphenyl)-N,N-diethyl-6-methyl-1-(4-methylphenyl)-2-oxo-1,2,3,4-tetrahydro-5-pyrimidincarboxamid [German] [ACD/IUPAC Name]
4-(3-Bromo-4-fluorophenyl)-N,N-diethyl-6-methyl-1-(4-methylphenyl)-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxamide [ACD/IUPAC Name]
4-(3-Bromo-4-fluorophényl)-N,N-diéthyl-6-méthyl-1-(4-méthylphényl)-2-oxo-1,2,3,4-tétrahydro-5-pyrimidinecarboxamide [French] [ACD/IUPAC Name]
5-Pyrimidinecarboxamide, 4-(3-bromo-4-fluorophenyl)-N,N-diethyl-1,2,3,4-tetrahydro-6-methyl-1-(4-methylphenyl)-2-oxo- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 641.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 94.6±3.0 kJ/mol
Flash Point: 341.5±31.5 °C
Index of Refraction: 1.585
Molar Refractivity: 118.0±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.92
ACD/LogD (pH 5.5): 4.20
ACD/BCF (pH 5.5): 922.78
ACD/KOC (pH 5.5): 4613.33
ACD/LogD (pH 7.4): 4.20
ACD/BCF (pH 7.4): 922.05
ACD/KOC (pH 7.4): 4609.73
Polar Surface Area: 53 Å2
Polarizability: 46.8±0.5 10-24cm3
Surface Tension: 45.4±3.0 dyne/cm
Molar Volume: 352.4±3.0 cm3

Click to predict properties on the Chemicalize site


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