ChemSpider 2D Image | 1H-pyrazolo[3,4-b]pyridin-6-ol, 4,5-dihydro-3-methyl-4-phenyl-1-(9H-purin-6-yl)- | C18H15N7O

1H-pyrazolo[3,4-b]pyridin-6-ol, 4,5-dihydro-3-methyl-4-phenyl-1-(9H-purin-6-yl)-

  • Molecular FormulaC18H15N7O
  • Average mass345.358 Da
  • Monoisotopic mass345.133820 Da
  • ChemSpider ID22498649

More details:

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

1H-pyrazolo[3,4-b]pyridin-6-ol, 4,5-dihydro-3-methyl-4-phenyl-1-(9H-purin-6-yl)-
3-Methyl-4-phenyl-1-(1H-purin-6-yl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-on [German] [ACD/IUPAC Name]
3-Methyl-4-phenyl-1-(1H-purin-6-yl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one [ACD/IUPAC Name]
3-Méthyl-4-phényl-1-(1H-purin-6-yl)-1,4,5,7-tétrahydro-6H-pyrazolo[3,4-b]pyridin-6-one [French] [ACD/IUPAC Name]
6H-Pyrazolo[3,4-b]pyridin-6-one, 1,4,5,7-tetrahydro-3-methyl-4-phenyl-1-(9H-purin-6-yl)- [ACD/Index Name]
1081132-29-7 [RN]
3-methyl-4-phenyl-1-(9H-purin-6-yl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
3-methyl-4-phenyl-1-(9H-purin-6-yl)-4,5-dihydro-1H-pyrazolo[3,4-b]pyridin-6(7H)-one
3-methyl-4-phenyl-1-(9H-purin-6-yl)-4,5-dihydro-1H-pyrazolo[3,4-b]pyridin-6-ol

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

    Density: 1.6±0.1 g/cm3
    Boiling Point: 691.1±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.2 mmHg at 25°C
    Enthalpy of Vaporization: 101.3±3.0 kJ/mol
    Flash Point: 371.8±31.5 °C
    Index of Refraction: 1.845
    Molar Refractivity: 95.7±0.5 cm3
    #H bond acceptors: 8
    #H bond donors: 2
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 2.66
    ACD/LogD (pH 5.5): 2.21
    ACD/BCF (pH 5.5): 27.94
    ACD/KOC (pH 5.5): 376.36
    ACD/LogD (pH 7.4): 1.97
    ACD/BCF (pH 7.4): 16.13
    ACD/KOC (pH 7.4): 217.30
    Polar Surface Area: 101 Å2
    Polarizability: 37.9±0.5 10-24cm3
    Surface Tension: 71.7±7.0 dyne/cm
    Molar Volume: 215.2±7.0 cm3

    Click to predict properties on the Chemicalize site


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