ChemSpider 2D Image | 4-(2-(2-fluorophenyl)-4-hydroxy-3-(4-methylbenzoyl)-5-oxo-2H-pyrrol-1(5H)-yl)-1,5-dimethyl-2-phenyl-1,2-dihydropyrazol-3-one | C29H24FN3O4

4-(2-(2-fluorophenyl)-4-hydroxy-3-(4-methylbenzoyl)-5-oxo-2H-pyrrol-1(5H)-yl)-1,5-dimethyl-2-phenyl-1,2-dihydropyrazol-3-one

  • Molecular FormulaC29H24FN3O4
  • Average mass497.517 Da
  • Monoisotopic mass497.175079 Da
  • ChemSpider ID17822342

More details:

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

3H-Pyrazol-3-one, 4-[2-(2-fluorophenyl)-2,5-dihydro-4-hydroxy-3-(4-methylbenzoyl)-5-oxo-1H-pyrrol-1-yl]-1,2-dihydro-1,5-dimethyl-2-phenyl- [ACD/Index Name]
4-(2-(2-fluorophenyl)-4-hydroxy-3-(4-methylbenzoyl)-5-oxo-2H-pyrrol-1(5H)-yl)-1,5-dimethyl-2-phenyl-1,2-dihydropyrazol-3-one
4-[2-(2-Fluorophenyl)-4-hydroxy-3-(4-methylbenzoyl)-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one [ACD/IUPAC Name]
4-[2-(2-Fluorophényl)-4-hydroxy-3-(4-méthylbenzoyl)-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]-1,5-diméthyl-2-phényl-1,2-dihydro-3H-pyrazol-3-one [French] [ACD/IUPAC Name]
4-[2-(2-Fluorphenyl)-4-hydroxy-3-(4-methylbenzoyl)-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-on [German] [ACD/IUPAC Name]
4-(2-(2-fluorophenyl)-4-hydroxy-3-(4-methylbenzoyl)-5-oxo-2,5-dihydro-1H-pyrrol-1-yl)-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one
4-{2-(2-fluorophenyl)-4-hydroxy-3-[(4-methylphenyl)carbonyl]-5-oxo-2,5-dihydro-1H-pyrrol-1-yl}-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
488121-17-1 [RN]

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 654.9±65.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.1 mmHg at 25°C
    Enthalpy of Vaporization: 101.3±3.0 kJ/mol
    Flash Point: 349.9±34.3 °C
    Index of Refraction: 1.675
    Molar Refractivity: 134.8±0.3 cm3
    #H bond acceptors: 7
    #H bond donors: 1
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 3.99
    ACD/LogD (pH 5.5): 2.22
    ACD/BCF (pH 5.5): 16.20
    ACD/KOC (pH 5.5): 129.34
    ACD/LogD (pH 7.4): 0.46
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 2.23
    Polar Surface Area: 81 Å2
    Polarizability: 53.5±0.5 10-24cm3
    Surface Tension: 62.5±3.0 dyne/cm
    Molar Volume: 358.7±3.0 cm3

    Click to predict properties on the Chemicalize site


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