ChemSpider 2D Image | LY3214996 | C22H27N7O2S

LY3214996

  • Molecular FormulaC22H27N7O2S
  • Average mass453.560 Da
  • Monoisotopic mass453.194702 Da
  • ChemSpider ID60598689

More details:

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

1951483-29-6 [RN]
4H-Thieno[2,3-c]pyrrol-4-one, 5,6-dihydro-6,6-dimethyl-2-[2-[(1-methyl-1H-pyrazol-5-yl)amino]-4-pyrimidinyl]-5-[2-(4-morpholinyl)ethyl]- [ACD/Index Name]
6,6-Dimethyl-2-{2-[(1-methyl-1H-pyrazol-5-yl)amino]-4-pyrimidinyl}-5-[2-(4-morpholinyl)ethyl]-5,6-dihydro-4H-thieno[2,3-c]pyrrol-4-on [German] [ACD/IUPAC Name]
6,6-Dimethyl-2-{2-[(1-methyl-1H-pyrazol-5-yl)amino]-4-pyrimidinyl}-5-[2-(4-morpholinyl)ethyl]-5,6-dihydro-4H-thieno[2,3-c]pyrrol-4-one [ACD/IUPAC Name]
6,6-Diméthyl-2-{2-[(1-méthyl-1H-pyrazol-5-yl)amino]-4-pyrimidinyl}-5-[2-(4-morpholinyl)éthyl]-5,6-dihydro-4H-thiéno[2,3-c]pyrrol-4-one [French] [ACD/IUPAC Name]
6,6-dimethyl-2-{2-[(1-methyl-1H-pyrazol-5-yl)amino]pyrimidin-4-yl}-5-[2-(morpholin-4-yl)ethyl]-4H,5H,6H-thieno[2,3-c]pyrrol-4-one
6,6-dimethyl-2-{2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl}-5-[2-(morpholin-4-yl)ethyl]thieno[2,3-c]pyrrol-4-one
LY3214996
1,10-Phenanthroline-2-carbaldehyde [ACD/IUPAC Name]
1,10-Phenanthroline-2-carboxaldehyde [ACD/Index Name]
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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: 711.5±70.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.3 mmHg at 25°C
    Enthalpy of Vaporization: 104.0±3.0 kJ/mol
    Flash Point: 384.1±35.7 °C
    Index of Refraction: 1.723
    Molar Refractivity: 125.3±0.5 cm3
    #H bond acceptors: 9
    #H bond donors: 1
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 1.36
    ACD/LogD (pH 5.5): 0.85
    ACD/BCF (pH 5.5): 1.42
    ACD/KOC (pH 5.5): 21.91
    ACD/LogD (pH 7.4): 1.88
    ACD/BCF (pH 7.4): 15.23
    ACD/KOC (pH 7.4): 235.40
    Polar Surface Area: 117 Å2
    Polarizability: 49.7±0.5 10-24cm3
    Surface Tension: 59.5±7.0 dyne/cm
    Molar Volume: 316.1±7.0 cm3

    Click to predict properties on the Chemicalize site


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