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    CAS 174649-09-3

    BUILDING BLOCK

    PharmaCompass
    Xls

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    2D Structure
    Also known as: 174649-09-3, (r)-[3-(3-fluoro-4-morpholinophenyl)-2-oxo-5-oxazolidinyl]methyl methanesulfonate, Linezolid mesylate ester, D02quu2jky, [(5r)-3-(3-fluoro-4-morpholin-4-ylphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl methanesulfonate, Linezolid related compound d [usp-rs]
    Molecular Formula
    C15H19FN2O6S
    Molecular Weight
    374.4  g/mol
    InChI Key
    UCVIKCGVGWBTTI-GFCCVEGCSA-N
    FDA UNII
    D02QUU2JKY
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    [(5R)-3-(3-fluoro-4-morpholin-4-ylphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl methanesulfonate
    2.1.2 InChI
    InChI=1S/C15H19FN2O6S/c1-25(20,21)23-10-12-9-18(15(19)24-12)11-2-3-14(13(16)8-11)17-4-6-22-7-5-17/h2-3,8,12H,4-7,9-10H2,1H3/t12-/m1/s1
    2.1.3 InChI Key
    UCVIKCGVGWBTTI-GFCCVEGCSA-N
    2.1.4 Canonical SMILES
    CS(=O)(=O)OCC1CN(C(=O)O1)C2=CC(=C(C=C2)N3CCOCC3)F
    2.1.5 Isomeric SMILES
    CS(=O)(=O)OC[C@H]1CN(C(=O)O1)C2=CC(=C(C=C2)N3CCOCC3)F
    2.2 Other Identifiers
    2.2.1 UNII
    D02QUU2JKY
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. 174649-09-3

    2. (r)-[3-(3-fluoro-4-morpholinophenyl)-2-oxo-5-oxazolidinyl]methyl Methanesulfonate

    3. Linezolid Mesylate Ester

    4. D02quu2jky

    5. [(5r)-3-(3-fluoro-4-morpholin-4-ylphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl Methanesulfonate

    6. Linezolid Related Compound D [usp-rs]

    7. (3-(3-fluoro-4-morpholinophenyl)-2-oxooxazolidin-5-yl)methyl Methanesulfonate, (r)-

    8. (5r)-3-(3-fluoro-4-(4-morpholinyl)phenyl)-5-(((methylsulfonyl)oxy)methyl)-2-oxazolidinone

    9. (5r)-3-[3-fluoro-4-(4-morpholinyl)phenyl]-5-[[(methylsulfonyl)oxy]methyl]-2-oxazolidinone

    10. 2-oxazolidinone, 3-(3-fluoro-4-(4-morpholinyl)phenyl)-5-(((methylsulfonyl)oxy)methyl)-, (r)-

    11. 2-oxazolidinone, 3-[3-fluoro-4-(4-morpholinyl)phenyl]-5-[[(methylsulfonyl)oxy]methyl]-, (5r)-

    12. Unii-d02quu2jky

    13. Linezolid Related Compound D

    14. Schembl12126884

    15. Dtxsid70442918

    16. Linezolid Related Compound D [usp]

    17. Mfcd18070719

    18. Zinc39140048

    19. Akos015913626

    20. Ds-3714

    21. (r)-(3-(3-fluoro-4-morpholinophenyl)-2-oxooxazolidin-5-yl)methylmethanesulfonate

    22. Am20030162

    23. Cs-0150118

    24. D78062

    25. A851827

    26. J-502106

    27. Linezolid Related Compound D [usp Impurity]

    28. ((r)-3-(3-fluoro-4-morpholinophenyl)-2-oxooxazolidin-5-yl)methyl Methanesulfonate

    29. ((r)-n-[[3-[3-fluro-4-morpholinyl]-phenyl]-2-oxo-5-oxazolidinyl]methyl] Methane Sulfonate

    30. (5r)-[3-(3-fluoro-4-morpholinophenyl)-2-oxooxazolidin-5-yl]methyl Methanesulfonate

    31. (r)-[3-(3-fluoro-4-morpholinophenyl)-2-oxo-5-oxazolidinyl]methylmethanesulfonate

    32. {(5r)-3-[3-fluoro-4-(morpholin-4-yl)phenyl]-2-oxo-1,3-oxazolidin-5-yl}methyl Methanesulfonate

    33. 2-oxazolidinone, 3-[3-fluoro-4-(4-morpholinyl)phenyl]-5-[[(methylsulfonyl)oxy]methyl]-, (5r)

    34. Methyl ((r)-3-(3-fluoro-4-morpholinophenyl)-2-oxooxazolidin-5-yl)methanesulfonate;(r)-(3-(3-fluoro-4-morpholinophenyl)-2-oxooxazolidin-5-yl)methyl Methanesulfonate

    2.4 Create Date
    2006-10-25
    3 Chemical and Physical Properties
    Molecular Weight 374.4 g/mol
    Molecular Formula C15H19FN2O6S
    XLogP30.8
    Hydrogen Bond Donor Count0
    Hydrogen Bond Acceptor Count8
    Rotatable Bond Count5
    Exact Mass374.09478567 g/mol
    Monoisotopic Mass374.09478567 g/mol
    Topological Polar Surface Area93.8 Ų
    Heavy Atom Count25
    Formal Charge0
    Complexity577
    Isotope Atom Count0
    Defined Atom Stereocenter Count1
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1