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    Technical details about Nanatinostat, learn more about the structure, uses, toxicity, action, side effects and more

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    Nanatinostat

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    DIGITAL CONTENT

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    Rochem, your partner in developing, sourcing, and supplying pharmaceutical & animal health ingredients of Chinese origin.

    AbbVie CDMO has been working with global companies to develop, manufacture & scale biopharmaceutical products.

    2D Structure
    1. Also known as:
    Molecular Formula
    C20H19FN6O2
    Molecular Weight
    394.4  g/mol
    InChI Key
    GTAUPYWUPNCTCZ-MVVMVCHASA-N
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    2-[(1R,5S)-6-[(6-fluoroquinolin-2-yl)methylamino]-3-azabicyclo[3.1.0]hexan-3-yl]-N-hydroxypyrimidine-4-carboxamide
    2.1.2 InChI
    InChI=1S/C20H19FN6O2/c21-12-2-4-16-11(7-12)1-3-13(24-16)8-23-18-14-9-27(10-15(14)18)20-22-6-5-17(25-20)19(28)26-29/h1-7,14-15,18,23,29H,8-10H2,(H,26,28)/t14-,15+,18?
    2.1.3 InChI Key
    GTAUPYWUPNCTCZ-MVVMVCHASA-N
    2.1.4 Canonical SMILES
    C1C2C(C2NCC3=NC4=C(C=C3)C=C(C=C4)F)CN1C5=NC=CC(=N5)C(=O)NO
    2.1.5 Isomeric SMILES
    C1[C@@H]2[C@@H](C2NCC3=NC4=C(C=C3)C=C(C=C4)F)CN1C5=NC=CC(=N5)C(=O)NO
    2.2 Create Date
    2019-07-12
    3 Chemical and Physical Properties
    Molecular Weight 394.4 g/mol
    Molecular Formula C20H19FN6O2
    XLogP31.4
    Hydrogen Bond Donor Count3
    Hydrogen Bond Acceptor Count8
    Rotatable Bond Count5
    Exact Mass394.15535203 g/mol
    Monoisotopic Mass394.15535203 g/mol
    Topological Polar Surface Area103 Ų
    Heavy Atom Count29
    Formal Charge0
    Complexity600
    Isotope Atom Count0
    Defined Atom Stereocenter Count2
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
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