loader
Please Wait
Applying Filters...

Minakem Generic APIs Minakem Generic APIs

X
menu

    Market Place

    Market Place

    Post Enquiry

    Post Enquiry
    menu

    Technical details about CAS 1256584-78-7, learn more about the structure, uses, toxicity, action, side effects and more

    Client Email Product
    Menu

    CAS 1256584-78-7

    Manufacturers/Suppliers

    PharmaCompass

    Symbiotec: Global API manufacturer, specializing in Cortico-Steroids & Steroid-Hormone APIs.

    Metrochem has been delivering customized volume & quality products to customers across the world, taking utmost care of their needs.

    2D Structure
    1. Also known as: 1256584-78-7, 6-cyano-2-[1-[4-ethyl-3-[4-(4-morpholinyl)-1-piperidinyl]phenyl]-1-methylethyl]-1h-indole-3-carboxylic acid, 6-cyano-2-[2-[4-ethyl-3-(4-morpholin-4-ylpiperidin-1-yl)phenyl]propan-2-yl]-1h-indole-3-carboxylic acid, Schembl898597, Amy3287, Dtxsid601109770
    Molecular Formula
    C30H36N4O3
    Molecular Weight
    500.6  g/mol
    InChI Key
    FNWCKBDSBRNQIL-UHFFFAOYSA-N
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    6-cyano-2-[2-[4-ethyl-3-(4-morpholin-4-ylpiperidin-1-yl)phenyl]propan-2-yl]-1H-indole-3-carboxylic acid
    2.1.2 InChI
    InChI=1S/C30H36N4O3/c1-4-21-6-7-22(18-26(21)34-11-9-23(10-12-34)33-13-15-37-16-14-33)30(2,3)28-27(29(35)36)24-8-5-20(19-31)17-25(24)32-28/h5-8,17-18,23,32H,4,9-16H2,1-3H3,(H,35,36)
    2.1.3 InChI Key
    FNWCKBDSBRNQIL-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CCC1=C(C=C(C=C1)C(C)(C)C2=C(C3=C(N2)C=C(C=C3)C#N)C(=O)O)N4CCC(CC4)N5CCOCC5
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. 1256584-78-7

    2. 6-cyano-2-[1-[4-ethyl-3-[4-(4-morpholinyl)-1-piperidinyl]phenyl]-1-methylethyl]-1h-indole-3-carboxylic Acid

    3. 6-cyano-2-[2-[4-ethyl-3-(4-morpholin-4-ylpiperidin-1-yl)phenyl]propan-2-yl]-1h-indole-3-carboxylic Acid

    4. Schembl898597

    5. Amy3287

    6. Dtxsid601109770

    7. Ac-30653

    8. Db-108083

    9. N17047

    10. 6-cyano-2-(2-(4-ethyl-3-(4-morpholin-4-yl-piperidin-1-yl)phenyl)propan-2-yl)-1h-indole-3-carboxylic Acid

    11. 6-cyano-2-[2-[4-ethyl-3-(4-morpholinopiperidine-1-yl)phenyl]propane-2-yl]-1h-indole-3-carboxylic Acid

    2.3 Create Date
    2012-11-30
    3 Chemical and Physical Properties
    Molecular Weight 500.6 g/mol
    Molecular Formula C30H36N4O3
    XLogP33
    Hydrogen Bond Donor Count2
    Hydrogen Bond Acceptor Count6
    Rotatable Bond Count6
    Exact Mass500.27874102 g/mol
    Monoisotopic Mass500.27874102 g/mol
    Topological Polar Surface Area92.6 Ų
    Heavy Atom Count37
    Formal Charge0
    Complexity841
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
    Post Enquiry
    POST ENQUIRY