ChemSpider 2D Image | 6,7-Difluoro-1-(4-fluorobenzyl)-3-[(3-methylphenyl)sulfonyl]-4(1H)-quinolinone | C23H16F3NO3S

6,7-Difluoro-1-(4-fluorobenzyl)-3-[(3-methylphenyl)sulfonyl]-4(1H)-quinolinone

  • Molecular FormulaC23H16F3NO3S
  • Average mass443.438 Da
  • Monoisotopic mass443.080292 Da
  • ChemSpider ID27318708

More details:

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

4(1H)-Quinolinone, 6,7-difluoro-1-[(4-fluorophenyl)methyl]-3-[(3-methylphenyl)sulfonyl]- [ACD/Index Name]
6,7-Difluor-1-(4-fluorbenzyl)-3-[(3-methylphenyl)sulfonyl]-4(1H)-chinolinon [German] [ACD/IUPAC Name]
6,7-Difluoro-1-(4-fluorobenzyl)-3-[(3-méthylphényl)sulfonyl]-4(1H)-quinoléinone [French] [ACD/IUPAC Name]
6,7-Difluoro-1-(4-fluorobenzyl)-3-[(3-methylphenyl)sulfonyl]-4(1H)-quinolinone [ACD/IUPAC Name]
[1326894-35-2] [RN]
1326894-35-2 [RN]
6,7-Difluoro-1-(4-fluoro-benzyl)-3-(toluene-3-sulfonyl)-1H-quinolin-4-one
6,7-difluoro-1-(4-fluorobenzyl)-3-[(3-methylphenyl)sulfonyl]quinolin-4(1H)-one
6,7-difluoro-1-[(4-fluorophenyl)methyl]-3-(3-methylbenzenesulfonyl)-1,4-dihydroquinolin-4-one
6,7-difluoro-1-[(4-fluorophenyl)methyl]-3-(3-methylphenyl)sulfonylquinolin-4-one
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.4±0.1 g/cm3
    Boiling Point: 630.6±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.8 mmHg at 25°C
    Enthalpy of Vaporization: 93.3±3.0 kJ/mol
    Flash Point: 335.2±31.5 °C
    Index of Refraction: 1.630
    Molar Refractivity: 110.1±0.4 cm3
    #H bond acceptors: 4
    #H bond donors: 0
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 4.36
    ACD/LogD (pH 5.5): 4.47
    ACD/BCF (pH 5.5): 1466.84
    ACD/KOC (pH 5.5): 6428.29
    ACD/LogD (pH 7.4): 4.47
    ACD/BCF (pH 7.4): 1466.84
    ACD/KOC (pH 7.4): 6428.29
    Polar Surface Area: 63 Å2
    Polarizability: 43.7±0.5 10-24cm3
    Surface Tension: 53.1±3.0 dyne/cm
    Molar Volume: 309.6±3.0 cm3

    Click to predict properties on the Chemicalize site


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