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    GXV813

    DEVELOPMENTS

    PharmaCompass
    Xls

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    2D Structure
    Also known as: Gxv813, Ex-a8078, 2640099-21-2, Schembl23212952, Exa8078, Gxv-813
    Molecular Formula
    C25H31FN4O4
    Molecular Weight
    470.5  g/mol
    InChI Key
    ORGCUCREOUHRLJ-IBGZPJMESA-N
    FDA UNII
    ZPB5JA37X4
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    (7S)-7-[4-[5-fluoro-2-(2-oxaspiro[3.3]heptan-6-yloxy)phenyl]piperidin-1-yl]-2-(1,3,4-oxadiazol-2-yl)-5-oxa-2-azaspiro[3.4]octane
    2.1.2 InChI
    InChI=1S/C25H31FN4O4/c26-18-1-2-22(34-20-9-24(10-20)14-31-15-24)21(7-18)17-3-5-29(6-4-17)19-8-25(33-11-19)12-30(13-25)23-28-27-16-32-23/h1-2,7,16-17,19-20H,3-6,8-15H2/t19-/m0/s1
    2.1.3 InChI Key
    ORGCUCREOUHRLJ-IBGZPJMESA-N
    2.2 Other Identifiers
    2.2.1 UNII
    ZPB5JA37X4
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. Gxv813

    2. Ex-a8078

    3. 2640099-21-2

    4. Schembl23212952

    5. Exa8078

    6. Gxv-813

    7. (7s)-7-[4-[5-fluoro-2-(2-oxaspiro[3.3]heptan-6-yloxy)phenyl]piperidin-1-yl]-2-(1,3,4-oxadiazol-2-yl)-5-oxa-2-azaspiro[3.4]octane

    2.4 Create Date
    2021-08-21
    3 Chemical and Physical Properties
    Molecular Weight 470.5 g/mol
    Molecular Formula C25H31FN4O4
    XLogP32.6
    Hydrogen Bond Donor Count0
    Hydrogen Bond Acceptor Count9
    Rotatable Bond Count5
    Exact Mass Da
    Monoisotopic Mass Da
    Topological Polar Surface Area73.1
    Heavy Atom Count34
    Formal Charge0
    Complexity734
    Isotope Atom Count0
    Defined Atom Stereocenter Count1
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
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