loader
Please Wait
Applying Filters...

Ofichem Header Ofichem Header

X
menu

    Market Place

    Market Place

    Post Enquiry

    Post Enquiry
    menu

    Technical details about ARV-471, learn more about the structure, uses, toxicity, action, side effects and more

    Client Email Product
    Menu

    ARV-471

    DEVELOPMENTS

    PRICE INFORMATION

    PharmaCompass

    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: 2229711-08-2, Arv471, Starbld0007729, Schembl20231167, Gtpl11511, Ex-a5021
    Molecular Formula
    C45H49N5O4
    Molecular Weight
    723.9  g/mol
    InChI Key
    TZZDVPMABRWKIZ-MFTLXVFQSA-N
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    3-[6-[4-[[1-[4-[(1R,2S)-6-hydroxy-2-phenyl-1,2,3,4-tetrahydronaphthalen-1-yl]phenyl]piperidin-4-yl]methyl]piperazin-1-yl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione
    2.1.2 InChI
    InChI=1S/C45H49N5O4/c51-37-12-15-39-33(27-37)8-13-38(31-4-2-1-3-5-31)43(39)32-6-9-35(10-7-32)48-20-18-30(19-21-48)28-47-22-24-49(25-23-47)36-11-14-40-34(26-36)29-50(45(40)54)41-16-17-42(52)46-44(41)53/h1-7,9-12,14-15,26-27,30,38,41,43,51H,8,13,16-25,28-29H2,(H,46,52,53)/t38-,41?,43+/m1/s1
    2.1.3 InChI Key
    TZZDVPMABRWKIZ-MFTLXVFQSA-N
    2.1.4 Canonical SMILES
    C1CC2=C(C=CC(=C2)O)C(C1C3=CC=CC=C3)C4=CC=C(C=C4)N5CCC(CC5)CN6CCN(CC6)C7=CC8=C(C=C7)C(=O)N(C8)C9CCC(=O)NC9=O
    2.1.5 Isomeric SMILES
    C1CC2=C(C=CC(=C2)O)[C@H]([C@H]1C3=CC=CC=C3)C4=CC=C(C=C4)N5CCC(CC5)CN6CCN(CC6)C7=CC8=C(C=C7)C(=O)N(C8)C9CCC(=O)NC9=O
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. 2229711-08-2

    2. Arv471

    3. Starbld0007729

    4. Schembl20231167

    5. Gtpl11511

    6. Ex-a5021

    7. Compound 341 [wo2018102725a1]

    8. 3-[6-[4-[[1-[4-[(1r,2s)-6-hydroxy-2-phenyl-1,2,3,4-tetrahydronaphthalen-1-yl]phenyl]piperidin-4-yl]methyl]piperazin-1-yl]-3-oxo-1h-isoindol-2-yl]piperidine-2,6-dione

    2.3 Create Date
    2018-06-23
    3 Chemical and Physical Properties
    Molecular Weight 723.9 g/mol
    Molecular Formula C45H49N5O4
    XLogP36.4
    Hydrogen Bond Donor Count2
    Hydrogen Bond Acceptor Count7
    Rotatable Bond Count7
    Exact Mass723.37845506 g/mol
    Monoisotopic Mass723.37845506 g/mol
    Topological Polar Surface Area96.4 Ų
    Heavy Atom Count54
    Formal Charge0
    Complexity1310
    Isotope Atom Count0
    Defined Atom Stereocenter Count2
    Undefined Atom Stereocenter Count1
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
    Post Enquiry
    POST ENQUIRY