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    Technical details about KER-047, learn more about the structure, uses, toxicity, action, side effects and more

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    KER-047

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    Minakem offers CDMO services for API & HPAPI, generics, regulatory expertise, track record performance & FDA & GMP certifications.

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    2D Structure
    1. Also known as: 8dlp7xk3vh, Ker047, 2248154-85-8, Ker-047, Quinoline, 7-fluoro-6-methoxy-4-(6-(4-(4-methyl-1-piperazinyl)-1-piperidinyl)pyrazolo(1,5-a)pyrimidin-3-yl)-, Unii-8dlp7xk3vh
    Molecular Formula
    C26H30FN7O
    Molecular Weight
    475.6  g/mol
    InChI Key
    UYQADNMBNQEQQG-UHFFFAOYSA-N
    FDA UNII
    8DLP7XK3VH
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    7-fluoro-6-methoxy-4-[6-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]pyrazolo[1,5-a]pyrimidin-3-yl]quinoline
    2.1.2 InChI
    InChI=1S/C26H30FN7O/c1-31-9-11-33(12-10-31)18-4-7-32(8-5-18)19-15-29-26-22(16-30-34(26)17-19)20-3-6-28-24-14-23(27)25(35-2)13-21(20)24/h3,6,13-18H,4-5,7-12H2,1-2H3
    2.1.3 InChI Key
    UYQADNMBNQEQQG-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CN1CCN(CC1)C2CCN(CC2)C3=CN4C(=C(C=N4)C5=C6C=C(C(=CC6=NC=C5)F)OC)N=C3
    2.2 Other Identifiers
    2.2.1 UNII
    8DLP7XK3VH
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. 8dlp7xk3vh

    2. Ker047

    3. 2248154-85-8

    4. Ker-047

    5. Quinoline, 7-fluoro-6-methoxy-4-(6-(4-(4-methyl-1-piperazinyl)-1-piperidinyl)pyrazolo(1,5-a)pyrimidin-3-yl)-

    6. Unii-8dlp7xk3vh

    7. Schembl22027704

    8. Ex-a4395

    9. Hy-136773

    10. Cs-0133581

    2.4 Create Date
    2019-12-06
    3 Chemical and Physical Properties
    Molecular Weight 475.6 g/mol
    Molecular Formula C26H30FN7O
    XLogP32.8
    Hydrogen Bond Donor Count0
    Hydrogen Bond Acceptor Count8
    Rotatable Bond Count4
    Exact Mass475.24958677 g/mol
    Monoisotopic Mass475.24958677 g/mol
    Topological Polar Surface Area62 Ų
    Heavy Atom Count35
    Formal Charge0
    Complexity701
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
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