ChemSpider 2D Image | 2-(1,3-Benzodioxol-5-yl)-3-(3,4-difluorophenyl)-2,3-dihydro-4(1H)-quinazolinone | C21H14F2N2O3

2-(1,3-Benzodioxol-5-yl)-3-(3,4-difluorophenyl)-2,3-dihydro-4(1H)-quinazolinone

  • Molecular FormulaC21H14F2N2O3
  • Average mass380.344 Da
  • Monoisotopic mass380.097260 Da
  • ChemSpider ID21631658

More details:

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

2-(1,3-Benzodioxol-5-yl)-3-(3,4-difluorophenyl)-2,3-dihydro-4(1H)-quinazolinone [ACD/IUPAC Name]
2-(1,3-Benzodioxol-5-yl)-3-(3,4-difluorophényl)-2,3-dihydro-4(1H)-quinazolinone [French] [ACD/IUPAC Name]
2-(1,3-Benzodioxol-5-yl)-3-(3,4-difluorphenyl)-2,3-dihydro-4(1H)-chinazolinon [German] [ACD/IUPAC Name]
4(1H)-Quinazolinone, 2-(1,3-benzodioxol-5-yl)-3-(3,4-difluorophenyl)-2,3-dihydro- [ACD/Index Name]
2-(1,3-benzodioxol-5-yl)-3-(3,4-difluorophenyl)-1,2-dihydroquinazolin-4-one
2-(1,3-benzodioxol-5-yl)-3-(3,4-difluorophenyl)-2,3-dihydroquinazolin-4(1H)-one
929813-98-9 [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: 584.3±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.6 mmHg at 25°C
    Enthalpy of Vaporization: 87.3±3.0 kJ/mol
    Flash Point: 307.2±30.1 °C
    Index of Refraction: 1.635
    Molar Refractivity: 95.9±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 1
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 3.40
    ACD/LogD (pH 5.5): 3.54
    ACD/BCF (pH 5.5): 290.95
    ACD/KOC (pH 5.5): 2019.31
    ACD/LogD (pH 7.4): 3.54
    ACD/BCF (pH 7.4): 290.95
    ACD/KOC (pH 7.4): 2019.31
    Polar Surface Area: 51 Å2
    Polarizability: 38.0±0.5 10-24cm3
    Surface Tension: 52.3±3.0 dyne/cm
    Molar Volume: 267.8±3.0 cm3

    Click to predict properties on the Chemicalize site


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