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Suanfarma Suanfarma

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    Technical details about NYX-2925, learn more about the structure, uses, toxicity, action, side effects and more

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    NYX 2925

    PharmaCompass

    Inke S.A: APIs manufacturing plant.

    ChemWerth works in generic API development & supply, non-infringement patent strategy development and regulatory support.

    2D Structure
    1. Also known as: 2012536-16-0
    Molecular Formula
    C14H23N3O4
    Molecular Weight
    297.35  g/mol
    InChI Key
    NFXPEHLDVKVVKA-RBZYPMLTSA-N
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    (2R,3S)-3-hydroxy-2-[(4S)-5-(2-methylpropanoyl)-3-oxo-2,5-diazaspiro[3.4]octan-2-yl]butanamide
    2.1.2 InChI
    InChI=1S/C14H23N3O4/c1-8(2)12(20)17-6-4-5-14(17)7-16(13(14)21)10(9(3)18)11(15)19/h8-10,18H,4-7H2,1-3H3,(H2,15,19)/t9-,10+,14-/m0/s1
    2.1.3 InChI Key
    NFXPEHLDVKVVKA-RBZYPMLTSA-N
    2.1.4 Canonical SMILES
    CC(C)C(=O)N1CCCC12CN(C2=O)C(C(C)O)C(=O)N
    2.1.5 Isomeric SMILES
    C[C@@H]([C@H](C(=O)N)N1C[C@]2(C1=O)CCCN2C(=O)C(C)C)O
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. 2012536-16-0

    2.3 Create Date
    2018-10-17
    3 Chemical and Physical Properties
    Molecular Weight 297.35 g/mol
    Molecular Formula C14H23N3O4
    XLogP3-0.9
    Hydrogen Bond Donor Count2
    Hydrogen Bond Acceptor Count4
    Rotatable Bond Count4
    Exact Mass297.16885622 g/mol
    Monoisotopic Mass297.16885622 g/mol
    Topological Polar Surface Area104 Ų
    Heavy Atom Count21
    Formal Charge0
    Complexity479
    Isotope Atom Count0
    Defined Atom Stereocenter Count3
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
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