ChemSpider 2D Image | 3-(6,7-Dihydroxy-1H-[1]benzofuro[3,2-b]pyrazolo[4,3-e]pyridin-4-yl)-1-methyl-2(1H)-quinolinone | C22H14N4O4

3-(6,7-Dihydroxy-1H-[1]benzofuro[3,2-b]pyrazolo[4,3-e]pyridin-4-yl)-1-methyl-2(1H)-quinolinone

  • Molecular FormulaC22H14N4O4
  • Average mass398.371 Da
  • Monoisotopic mass398.101501 Da
  • ChemSpider ID32513180

More details:

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

2(1H)-Quinolinone, 3-(6,7-dihydroxy-1H-benzofuro[3,2-b]pyrazolo[4,3-e]pyridin-4-yl)-1-methyl- [ACD/Index Name]
3-(6,7-Dihydroxy-1H-[1]benzofuro[3,2-b]pyrazolo[4,3-e]pyridin-4-yl)-1-methyl-2(1H)-chinolinon [German] [ACD/IUPAC Name]
3-(6,7-Dihydroxy-1H-[1]benzofuro[3,2-b]pyrazolo[4,3-e]pyridin-4-yl)-1-méthyl-2(1H)-quinoléinone [French] [ACD/IUPAC Name]
3-(6,7-Dihydroxy-1H-[1]benzofuro[3,2-b]pyrazolo[4,3-e]pyridin-4-yl)-1-methyl-2(1H)-quinolinone [ACD/IUPAC Name]
1630831-22-9 [RN]
3-(6,7-dihydroxy-2H-[1]benzofuro[3,2-b]pyrazolo[4,3-e]pyridin-4-yl)-1-methylquinolin-2(1H)-one
3-(6,7-dihydroxy-2H-benzofuro[3,2-b]pyrazolo[4,3-e]pyridin-4-yl)-1-methylquinolin-2(1H)-one

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

    Density: 1.6±0.1 g/cm3
    Boiling Point: 723.3±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.4 mmHg at 25°C
    Enthalpy of Vaporization: 109.4±3.0 kJ/mol
    Flash Point: 391.2±32.9 °C
    Index of Refraction: 1.863
    Molar Refractivity: 111.1±0.3 cm3
    #H bond acceptors: 8
    #H bond donors: 3
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 2.63
    ACD/LogD (pH 5.5): 2.01
    ACD/BCF (pH 5.5): 19.83
    ACD/KOC (pH 5.5): 294.51
    ACD/LogD (pH 7.4): 1.78
    ACD/BCF (pH 7.4): 11.72
    ACD/KOC (pH 7.4): 174.10
    Polar Surface Area: 115 Å2
    Polarizability: 44.0±0.5 10-24cm3
    Surface Tension: 98.2±3.0 dyne/cm
    Molar Volume: 246.1±3.0 cm3

    Click to predict properties on the Chemicalize site


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