Please Wait
Applying Filters...
menu
    • menu
    munit-sa-m-2025-04-14

    Virtual Booth

    Contact Supplier

    Polpharma is a Polish CDMO of APIs and a significant European API producer, delivering products to companies worldwide.

    Virtual Booth

    Contact Supplier

    SPI Pharma has been solving formulation challenges using superior functional materials.

    Virtual Booth

    Contact Supplier

    Granules India Limited has high volume world-class facilities for APIs, PFIs, & FDFs, serving customers in over 80 countries.

    Virtual Booth

    Contact Supplier

    Suanfarma, at the Core of a Better Life.

    Virtual Booth

    Contact Supplier

    xyz-pharma-m-2025-04-14

    Virtual Booth

    Contact Supplier

    Menu

    Contezolid Acefosamil

    DEVELOPMENTS

    PharmaCompass
    Xls

    Filters

    clear-filterReset all filters
    2D Structure
    Also known as: Mrx-4 sodium, Contezolid acefosamil [usan], Contezolid acefosamil (sodium), 1807365-35-0, T79c086548, Contezolid acefosamil (usan)
    Molecular Formula
    C20H17F3N4NaO8P
    Molecular Weight
    552.3  g/mol
    InChI Key
    JANNTEAGZXJITO-BTQNPOSSSA-M
    FDA UNII
    T79C086548
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    sodium;acetyloxy-[1,2-oxazol-3-yl-[[(5R)-2-oxo-3-[2,3,5-trifluoro-4-(4-oxo-2,3-dihydropyridin-1-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]amino]phosphinate
    2.1.2 InChI
    InChI=1S/C20H18F3N4O8P.Na/c1-11(28)35-36(31,32)27(16-4-7-33-24-16)10-13-9-26(20(30)34-13)15-8-14(21)19(18(23)17(15)22)25-5-2-12(29)3-6-25;/h2,4-5,7-8,13H,3,6,9-10H2,1H3,(H,31,32);/q;+1/p-1/t13-;/m1./s1
    2.1.3 InChI Key
    JANNTEAGZXJITO-BTQNPOSSSA-M
    2.1.4 Canonical SMILES
    CC(=O)OP(=O)(N(CC1CN(C(=O)O1)C2=CC(=C(C(=C2F)F)N3CCC(=O)C=C3)F)C4=NOC=C4)[O-].[Na+]
    2.1.5 Isomeric SMILES
    CC(=O)OP(=O)(N(C[C@H]1CN(C(=O)O1)C2=CC(=C(C(=C2F)F)N3CCC(=O)C=C3)F)C4=NOC=C4)[O-].[Na+]
    2.2 Other Identifiers
    2.2.1 UNII
    T79C086548
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. Mrx-4 Sodium

    2. Contezolid Acefosamil [usan]

    3. Contezolid Acefosamil (sodium)

    4. 1807365-35-0

    5. T79c086548

    6. Contezolid Acefosamil (usan)

    7. Prodrug Of Contezolid (mrx-1)

    8. Acetic (5r)-isoxazol-3yl((2-oxo-3-(2,3,5-trifluoro-4-(4-oxo-3,4-dihydropyridin-1(2h)-yl)phenyl)oxazolidin-5-yl)methyl)phosphoramidic Anhydride, Sodium Salt (1:1)

    9. Acetic Acid, Anhydride With N-(((5r)-3-(4-(3,4-dihydro-4-oxo-1(2h)-pyridinyl)-2,3,5-trifluorophenyl)-2-oxo-5-oxazolidinyl)methyl)-n-3-isoxazolylphosphoramidic Acid, Sodium Salt (1:1:1)

    10. Sodium;acetyloxy-[1,2-oxazol-3-yl-[[(5r)-2-oxo-3-[2,3,5-trifluoro-4-(4-oxo-2,3-dihydropyridin-1-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]amino]phosphinate

    11. Chembl3989966

    12. Unii-t79c086548

    13. Hy-19915b

    14. Cs-0138689

    15. D11298

    16. Sodium O-acetyl-(r)-isoxazol-3-yl((2-oxo-3-(2,3,5-trifluoro-4-(4-oxo-3,4-dihydropyridin-1(2h)-yl)phenyl)oxazolidin-5-yl)methyl)phosphoramidate

    2.4 Create Date
    2017-11-19
    3 Chemical and Physical Properties
    Molecular Weight 552.3 g/mol
    Molecular Formula C20H17F3N4NaO8P
    Hydrogen Bond Donor Count0
    Hydrogen Bond Acceptor Count14
    Rotatable Bond Count8
    Exact Mass552.06337928 g/mol
    Monoisotopic Mass552.06337928 g/mol
    Topological Polar Surface Area146 Ų
    Heavy Atom Count37
    Formal Charge0
    Complexity967
    Isotope Atom Count0
    Defined Atom Stereocenter Count1
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count2