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    Crofelemer

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    2D Structure
    Also known as: 148465-45-6, Cid 17397714, Zinc9497828, Akos016487279, Z164754034, 923916-82-9
    Molecular Formula
    C18H16N2O3
    Molecular Weight
    308.3  g/mol
    InChI Key
    JDNAIBCYTQGWFC-UHFFFAOYSA-N
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    N-[(2-methoxyphenyl)methyl]-5-phenyl-1,2-oxazole-3-carboxamide
    2.1.2 InChI
    InChI=1S/C18H16N2O3/c1-22-16-10-6-5-9-14(16)12-19-18(21)15-11-17(23-20-15)13-7-3-2-4-8-13/h2-11H,12H2,1H3,(H,19,21)
    2.1.3 InChI Key
    JDNAIBCYTQGWFC-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    COC1=CC=CC=C1CNC(=O)C2=NOC(=C2)C3=CC=CC=C3
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. 148465-45-6

    2. Cid 17397714

    3. Zinc9497828

    4. Akos016487279

    5. Z164754034

    6. 923916-82-9

    2.3 Create Date
    2007-11-13
    3 Chemical and Physical Properties
    Molecular Weight 308.3 g/mol
    Molecular Formula C18H16N2O3
    XLogP33.1
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count4
    Rotatable Bond Count5
    Exact Mass308.11609238 g/mol
    Monoisotopic Mass308.11609238 g/mol
    Topological Polar Surface Area64.4 Ų
    Heavy Atom Count23
    Formal Charge0
    Complexity385
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
    4 Drug and Medication Information
    4.1 Drug Information
    1 of 1  
    Drug NameMYTESI
    Active IngredientCROFELEMER
    CompanyNAPO PHARMS INC (Application Number: N202292. Patents: 7323195, 7341744, 8574634, 8962680, 9585868)