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    Chemistry

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    Also known as: Ov935, 1429505-03-2, Tak-935, Soticlestat [inn], Soticlestat [usan], Ov-935
    Molecular Formula
    C23H23N3O2
    Molecular Weight
    373.4  g/mol
    InChI Key
    XKUZMIUSBMCVPP-UHFFFAOYSA-N
    FDA UNII
    1766MU795L
    Soticlestat
    1 2D Structure

    Soticlestat

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    (4-benzyl-4-hydroxypiperidin-1-yl)-(2-pyridin-4-ylpyridin-3-yl)methanone
    2.1.2 InChI
    InChI=1S/C23H23N3O2/c27-22(20-7-4-12-25-21(20)19-8-13-24-14-9-19)26-15-10-23(28,11-16-26)17-18-5-2-1-3-6-18/h1-9,12-14,28H,10-11,15-17H2
    2.1.3 InChI Key
    XKUZMIUSBMCVPP-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C1CN(CCC1(CC2=CC=CC=C2)O)C(=O)C3=C(N=CC=C3)C4=CC=NC=C4
    2.2 Other Identifiers
    2.2.1 UNII
    1766MU795L
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. (4-benzyl-4-hydroxy-1-piperidinyl)(2,4'-bipyridin-3-yl)methanone

    2. Ov-935

    3. Ov935

    2.3.2 Depositor-Supplied Synonyms

    1. Ov935

    2. 1429505-03-2

    3. Tak-935

    4. Soticlestat [inn]

    5. Soticlestat [usan]

    6. Ov-935

    7. Tak935

    8. Soticlestat (usan)

    9. 1766mu795l

    10. (4-benzyl-4-hydroxypiperidin-1-yl)-(2-pyridin-4-ylpyridin-3-yl)methanone

    11. [4-oxidanyl-4-(phenylmethyl)piperidin-1-yl]-(2-pyridin-4-ylpyridin-3-yl)methanone

    12. Soticlestat [usan:inn]

    13. Chembl4298172

    14. Schembl14841089

    15. Unii-1766mu795l

    16. Gtpl11517

    17. Who 10844

    18. Hy-109123

    19. Cs-0078356

    20. D11590

    21. (4-benzyl-4-hydroxypiperidin-1-yl) (2,4'-bipyridin-3-yl)methanone

    22. (4-benzyl-4-hydroxypiperidin-1-yl)(2,4'-bipyridin-3-yl)methanone

    23. [2,4'-bipyridin]-3-yl(4-benzyl-4-hydroxypiperidin-1-yl)methanone

    24. 2,4'-bipyridin-3-yl(4-benzyl-4-hydroxypiperidin-1-yl)methanone

    25. Ybs

    2.4 Create Date
    2014-04-21
    3 Chemical and Physical Properties
    Molecular Weight 373.4 g/mol
    Molecular Formula C23H23N3O2
    XLogP32.5
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count4
    Rotatable Bond Count4
    Exact Mass373.17902698 g/mol
    Monoisotopic Mass373.17902698 g/mol
    Topological Polar Surface Area66.3 Ų
    Heavy Atom Count28
    Formal Charge0
    Complexity506
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
    4 Drug and Medication Information
    4.1 Drug Indication

    Treatment of Chromosome 15q Duplication Syndrome, Treatment of Cyclin-Dependent Kinase-Like 5 deficiency disorder

    Treatment of Dravet syndrome, Treatment of Lennox-Gastaut syndrome

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