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    168828-84-0

    BUILDING BLOCK

    PharmaCompass
    Xls

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    2D Structure
    Also known as: 168828-84-0, Deacetamide linezolid azide, Rk3z2b8jfw, (5r)-5-(azidomethyl)-3-(3-fluoro-4-morpholin-4-ylphenyl)-1,3-oxazolidin-2-one, (5r)-5-(azidomethyl)-3-(3-fluoro-4-(4-morpholinyl)phenyl)-2-oxazolidinone, (r)-(3-(3-fluoro-4-morpholin-4-ylphenyl)-2-oxo-5-oxazolidinyl)methyl azide
    Molecular Formula
    C14H16FN5O3
    Molecular Weight
    321.31  g/mol
    InChI Key
    FQUBFDDPWLBKIZ-NSHDSACASA-N
    FDA UNII
    RK3Z2B8JFW
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    (5R)-5-(azidomethyl)-3-(3-fluoro-4-morpholin-4-ylphenyl)-1,3-oxazolidin-2-one
    2.1.2 InChI
    InChI=1S/C14H16FN5O3/c15-12-7-10(1-2-13(12)19-3-5-22-6-4-19)20-9-11(8-17-18-16)23-14(20)21/h1-2,7,11H,3-6,8-9H2/t11-/m0/s1
    2.1.3 InChI Key
    FQUBFDDPWLBKIZ-NSHDSACASA-N
    2.1.4 Canonical SMILES
    C1COCCN1C2=C(C=C(C=C2)N3CC(OC3=O)CN=[N+]=[N-])F
    2.1.5 Isomeric SMILES
    C1COCCN1C2=C(C=C(C=C2)N3C[C@@H](OC3=O)CN=[N+]=[N-])F
    2.2 Other Identifiers
    2.2.1 UNII
    RK3Z2B8JFW
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. 168828-84-0

    2. Deacetamide Linezolid Azide

    3. Rk3z2b8jfw

    4. (5r)-5-(azidomethyl)-3-(3-fluoro-4-morpholin-4-ylphenyl)-1,3-oxazolidin-2-one

    5. (5r)-5-(azidomethyl)-3-(3-fluoro-4-(4-morpholinyl)phenyl)-2-oxazolidinone

    6. (r)-(3-(3-fluoro-4-morpholin-4-ylphenyl)-2-oxo-5-oxazolidinyl)methyl Azide

    7. (r)-5-azidomethyl-3-(3-fluoro-4-(morpholin-4-yl)phenyl)oxazolidin-2-one

    8. (5r)-5-(azidomethyl)-3-[3-fluoro-4-(morpholin-4-yl)phenyl]-1,3-oxazolidin-2-one

    9. (r)-(n-(3-fluoro-4-(morpholin-4-yl)phenyl)-2-oxo-5-oxazolidinyl)methyl Azide

    10. 2-oxazolidinone, 5-(azidomethyl)-3-(3-fluoro-4-(4-morpholinyl)phenyl)-, (5r)-

    11. 2-oxazolidinone, 5-(azidomethyl)-3-(3-fluoro-4-(4-morpholinyl)phenyl)-, (r)-

    12. 2-oxazolidinone, 5-(azidomethyl)-3-[3-fluoro-4-(4-morpholinyl)phenyl]-, (5r)-

    13. (r)-5-(azidomethyl)-3-(3-fluoro-4-(4-morpholinyl)phenyl)-2-oxazolidinone

    14. Linezolide Impurity A

    15. Unii-rk3z2b8jfw

    16. (r)-5-(azidomethyl)-3-(3-fluoro-4-morpholinophenyl)oxazolidin-2-one

    17. Chembl5198706

    18. Schembl13803066

    19. Dtxsid10937555

    20. Fqubfddpwlbkiz-nshdsacasa-n

    21. Bcp12788

    22. Cs-o-31988

    23. As-82502

    24. A1-03403

    25. (5r)-5-(azidomethyl)-3-(3-fluoro-4-morpholinphenyl)oxazolidinone-2- One

    26. (5r)-3-(3-fluoro-4-morpholinophenyl)-5alpha-(azidomethyl)oxazolidine-2-one

    27. 5-(azidomethyl)-3-[3-fluoro-4-(morpholin-4-yl)phenyl]-1,3-oxazolidin-2-one

    28. (r)-5-(azidomethyl)-3-(3-fluoro-4-morpholinophenyl)oxazolidin-2-one; Linezolid Related Compound A; Deacetamide Linezolid Azide; Linezolid Related Compound A

    2.4 Create Date
    2006-10-25
    3 Chemical and Physical Properties
    Molecular Weight 321.31 g/mol
    Molecular Formula C14H16FN5O3
    XLogP32.3
    Hydrogen Bond Donor Count0
    Hydrogen Bond Acceptor Count7
    Rotatable Bond Count4
    Exact Mass g/mol
    Monoisotopic Mass g/mol
    Topological Polar Surface Area56.4
    Heavy Atom Count23
    Formal Charge0
    Complexity481
    Isotope Atom Count0
    Defined Atom Stereocenter Count1
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1