Please Wait
Applying Filters...
menu
    • menu
    Suanfarma, at the Core of a Better Life.

    Virtual Booth

    Contact Supplier

    Bloomage is a one-stop source for CEP Sodium Hyaluronate and Hyaluronic Acid// FDA-inspected & GMP-certified.

    Virtual Booth

    Contact Supplier

    Egis is a Hungarian generic pharma company with 110 years history. Our activities incorporate all areas of the pharma value chain.

    Virtual Booth

    Contact Supplier

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

    Virtual Booth

    Contact Supplier

    Transo-Pharm GmbH works globally to supply Active Pharmaceutical Ingredients adhering to the highest quality & GMP standards.

    Virtual Booth

    Contact Supplier

    xyz-pharma-m-2025-01-20

    Virtual Booth

    Contact Supplier

    Menu

    Tinlarebant

    DEVELOPMENTS

    DIGITAL CONTENT

    PharmaCompass
    Xls

    Filters

    clear-filterReset all filters
    2D Structure
    Also known as: Tinlarebant [usan], Lbs-008, Bpn-14967, 63wi9s8p1m, 1-(3-(4-(3,4-difluoro-2-(trifluoromethyl)phenyl)piperidine-1-carbonyl)-1h,4h,5h,6h,7h-pyrazolo(3,4-c)pyridin-6-yl)ethan-1-one, 1821327-95-0
    Molecular Formula
    C21H21F5N4O2
    Molecular Weight
    456.4  g/mol
    InChI Key
    HAGSLCBZFRRBLS-UHFFFAOYSA-N
    FDA UNII
    63WI9S8P1M
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    1-[3-[4-[3,4-difluoro-2-(trifluoromethyl)phenyl]piperidine-1-carbonyl]-1,4,5,7-tetrahydropyrazolo[3,4-c]pyridin-6-yl]ethanone
    2.1.2 InChI
    InChI=1S/C21H21F5N4O2/c1-11(31)30-9-6-14-16(10-30)27-28-19(14)20(32)29-7-4-12(5-8-29)13-2-3-15(22)18(23)17(13)21(24,25)26/h2-3,12H,4-10H2,1H3,(H,27,28)
    2.1.3 InChI Key
    HAGSLCBZFRRBLS-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CC(=O)N1CCC2=C(C1)NN=C2C(=O)N3CCC(CC3)C4=C(C(=C(C=C4)F)F)C(F)(F)F
    2.2 Other Identifiers
    2.2.1 UNII
    63WI9S8P1M
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. Tinlarebant [usan]

    2. Lbs-008

    3. Bpn-14967

    4. 63wi9s8p1m

    5. 1-(3-(4-(3,4-difluoro-2-(trifluoromethyl)phenyl)piperidine-1-carbonyl)-1h,4h,5h,6h,7h-pyrazolo(3,4-c)pyridin-6-yl)ethan-1-one

    6. 1821327-95-0

    7. Ethanone, 1-(3-((4-(3,4-difluoro-2-(trifluoromethyl)phenyl)-1-piperidinyl)carbonyl)-1,4,5,7-tetrahydro-6h-pyrazolo(3,4-c)pyridin-6-yl)

    8. Tinlarebant [inn]

    9. Unii-63wi9s8p1m

    10. Chembl3967849

    11. Schembl17223028

    12. Bdbm249482

    13. Who 11058

    14. Us9434727, 80

    15. Us9434727, 81

    16. 1-(3-(4-(3,4-difluoro-2-(trifluoromethyl)phenyl)piperidine-1-carbonyl)-4,5-dihydro-1h-pyrazolo[3,4-c]pyridin-6(7h)-yl)ethanone

    2.4 Create Date
    2015-11-16
    3 Chemical and Physical Properties
    Molecular Weight 456.4 g/mol
    Molecular Formula C21H21F5N4O2
    XLogP32.7
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count8
    Rotatable Bond Count2
    Exact Mass456.15846674 g/mol
    Monoisotopic Mass456.15846674 g/mol
    Topological Polar Surface Area69.3 Ų
    Heavy Atom Count32
    Formal Charge0
    Complexity715
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1