ChemSpider 2D Image | 3-[(1-Ethyl-5-isopropyl-3-methyl-1H-pyrazolo[4,3-d]pyrimidin-7-yl)amino]-1-propanol | C14H23N5O

3-[(1-Ethyl-5-isopropyl-3-methyl-1H-pyrazolo[4,3-d]pyrimidin-7-yl)amino]-1-propanol

  • Molecular FormulaC14H23N5O
  • Average mass277.365 Da
  • Monoisotopic mass277.190247 Da
  • ChemSpider ID28470480

More details:

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

1-Propanol, 3-[[1-ethyl-3-methyl-5-(1-methylethyl)-1H-pyrazolo[4,3-d]pyrimidin-7-yl]amino]- [ACD/Index Name]
3-[(1-Ethyl-5-isopropyl-3-methyl-1H-pyrazolo[4,3-d]pyrimidin-7-yl)amino]-1-propanol [German] [ACD/IUPAC Name]
3-[(1-Ethyl-5-isopropyl-3-methyl-1H-pyrazolo[4,3-d]pyrimidin-7-yl)amino]-1-propanol [ACD/IUPAC Name]
3-[(1-Éthyl-5-isopropyl-3-méthyl-1H-pyrazolo[4,3-d]pyrimidin-7-yl)amino]-1-propanol [French] [ACD/IUPAC Name]
1354502-25-2 [RN]
3-[(1-ethyl-3-methyl-5-propan-2-ylpyrazolo[4,3-d]pyrimidin-7-yl)amino]propan-1-ol
3-{[1-ethyl-3-methyl-5-(propan-2-yl)-1H-pyrazolo[4,3-d]pyrimidin-7-yl]amino}propan-1-ol

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 420.5±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 71.1±3.0 kJ/mol
    Flash Point: 208.1±28.7 °C
    Index of Refraction: 1.614
    Molar Refractivity: 78.3±0.5 cm3
    #H bond acceptors: 6
    #H bond donors: 2
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 1.15
    ACD/LogD (pH 5.5): 1.78
    ACD/BCF (pH 5.5): 10.76
    ACD/KOC (pH 5.5): 150.14
    ACD/LogD (pH 7.4): 2.13
    ACD/BCF (pH 7.4): 24.55
    ACD/KOC (pH 7.4): 342.43
    Polar Surface Area: 76 Å2
    Polarizability: 31.0±0.5 10-24cm3
    Surface Tension: 42.8±7.0 dyne/cm
    Molar Volume: 224.4±7.0 cm3

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