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    Atinvicitinib

    ACTIVE PHARMA INGREDIENTS

    PharmaCompass
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    2D Structure
    Also known as: 2169273-59-8, Atinvicitinib [inn], C238ye66p2, 1-((3r,4s)-4-cyanotetrahydro-2h-pyran-3-yl)-3-((2-fluoro-6-methoxy-4-pyridinyl)amino)-1h-pyrazole-4-carboxamide, 1h-pyrazole-4-carboxamide, 1-((3r,4s)-4-cyanotetrahydro-2h-pyran-3-yl)-3-((2-fluoro-6-methoxy-4-pyridinyl)amino)-, Refchem:115425
    Molecular Formula
    C16H17FN6O3
    Molecular Weight
    360.34  g/mol
    InChI Key
    PRQMBGDYXWVEHE-SKDRFNHKSA-N
    FDA UNII
    C238YE66P2
    Atinvicitinib is a small molecule drug. The usage of the INN stem '-citinib' in the name indicates that Atinvicitinib is a Janus kinase inhibitor. Atinvicitinib has a monoisotopic molecular weight of 360.13 Da.
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    1-[(3R,4S)-4-cyanooxan-3-yl]-3-[(2-fluoro-6-methoxy-4-pyridinyl)amino]pyrazole-4-carboxamide
    2.1.2 InChI
    InChI=1S/C16H17FN6O3/c1-25-14-5-10(4-13(17)21-14)20-16-11(15(19)24)7-23(22-16)12-8-26-3-2-9(12)6-18/h4-5,7,9,12H,2-3,8H2,1H3,(H2,19,24)(H,20,21,22)/t9-,12+/m1/s1
    2.1.3 InChI Key
    PRQMBGDYXWVEHE-SKDRFNHKSA-N
    2.2 Other Identifiers
    2.2.1 UNII
    C238YE66P2
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. 2169273-59-8

    2. Atinvicitinib [inn]

    3. C238ye66p2

    4. 1-((3r,4s)-4-cyanotetrahydro-2h-pyran-3-yl)-3-((2-fluoro-6-methoxy-4-pyridinyl)amino)-1h-pyrazole-4-carboxamide

    5. 1h-pyrazole-4-carboxamide, 1-((3r,4s)-4-cyanotetrahydro-2h-pyran-3-yl)-3-((2-fluoro-6-methoxy-4-pyridinyl)amino)-

    6. Refchem:115425

    7. Unii-c238ye66p2

    8. Chembl4066193

    9. 1-((3r,4s)-4-cyanotetrahydro-2h-pyran-3-yl)-3-((2-fluoro-6-methoxypyridin-4-yl)amino)-1h-pyrazole-4-carboxamide

    10. 1-[(3r,4s)-4-cyanooxan-3-yl]-3-[(2-fluoro-6-methoxypyridin-4-yl)amino]pyrazole-4-carboxamide

    11. Orb3027320

    12. Schembl20284832

    13. Schembl29794840

    14. Glxc-26807

    15. Bdbm50250929

    16. Akos040757378

    17. Da-61294

    18. Hy-145551

    19. Cs-0375961

    20. T39646

    2.4 Create Date
    2018-12-15
    3 Chemical and Physical Properties
    Molecular Weight 360.34 g/mol
    Molecular Formula C16H17FN6O3
    XLogP30.9
    Hydrogen Bond Donor Count2
    Hydrogen Bond Acceptor Count8
    Rotatable Bond Count5
    Exact Mass Da
    Monoisotopic Mass Da
    Topological Polar Surface Area128
    Heavy Atom Count26
    Formal Charge0
    Complexity557
    Isotope Atom Count0
    Defined Atom Stereocenter Count2
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
    4 Pharmacology and Biochemistry
    4.1 ATC Code

    ATCvet Code

    QD - Dermatologicals

    QD11 - Other dermatological preparations

    QD11A - Other dermatological preparations

    QD11AH - Agents for dermatitis, excluding corticosteroids

    QD11AH93 - Atinvicitinib

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