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    Chemistry

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    Also known as: Besifloxacin hcl, 405165-61-9, Besivance, Besifloxacin (hydrochloride), Bol-303224-a, Besifloxacin hydrochloride [usan]
    Molecular Formula
    C19H22Cl2FN3O3
    Molecular Weight
    430.3  g/mol
    InChI Key
    PMQBICKXAAKXAY-HNCPQSOCSA-N
    FDA UNII
    7506A6J57T
    Besifloxacin Hydrochloride
    1 2D Structure

    Besifloxacin Hydrochloride

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    7-[(3R)-3-aminoazepan-1-yl]-8-chloro-1-cyclopropyl-6-fluoro-4-oxoquinoline-3-carboxylic acid;hydrochloride
    2.1.2 InChI
    InChI=1S/C19H21ClFN3O3.ClH/c20-15-16-12(18(25)13(19(26)27)9-24(16)11-4-5-11)7-14(21)17(15)23-6-2-1-3-10(22)8-23;/h7,9-11H,1-6,8,22H2,(H,26,27);1H/t10-;/m1./s1
    2.1.3 InChI Key
    PMQBICKXAAKXAY-HNCPQSOCSA-N
    2.1.4 Canonical SMILES
    C1CCN(CC(C1)N)C2=C(C=C3C(=C2Cl)N(C=C(C3=O)C(=O)O)C4CC4)F.Cl
    2.1.5 Isomeric SMILES
    C1CCN(C[C@@H](C1)N)C2=C(C=C3C(=C2Cl)N(C=C(C3=O)C(=O)O)C4CC4)F.Cl
    2.2 Other Identifiers
    2.2.1 UNII
    7506A6J57T
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. 7-((3r)-aminohexahydro-1h-azepin-1-yl)-8-chloro-1-cyclopropyl-6-fluoro-1,4-dihydro-4-oxo-3-quinolinecarboxylic Acid

    2. 7-(3-aminohexahydro-1h-azepin-1-yl)-8-chloro-1-cyclopropyl-6-fluoro-1,4-dihydro-4-oxo-3-quinolinecarboxylic Acid

    3. Besifloxacin

    4. Besivance

    5. Bol-303224-a

    2.3.2 Depositor-Supplied Synonyms

    1. Besifloxacin Hcl

    2. 405165-61-9

    3. Besivance

    4. Besifloxacin (hydrochloride)

    5. Bol-303224-a

    6. Besifloxacin Hydrochloride [usan]

    7. Ss734

    8. Besifloxacin Hcl (besivance)

    9. Besifloxacin (as Hydrochloride)

    10. Ss-734

    11. 7506a6j57t

    12. 405165-61-9 (hcl)

    13. Unii-7506a6j57t

    14. Besifloxacin Hydrochloride (usan)

    15. (+)-7-((3r)-3-aminohexahydro-1h-azepin-1-yl)-8-chloro-1-cyclopropyl-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic Acid Hydrochloride

    16. (+)-7-[(3r)-3-aminohexahydro-1h-azepin-1-yl]-8-chloro-1- Cyclopropyl-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic Acid Hydrochloride.

    17. (r)-7-(3-aminoazepan-1-yl)-8-chloro-1-cyclopropyl-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic Acid Hydrochloride

    18. 3-quinolinecarboxylic Acid, 7-((3r)-3-aminohexahydro-1h-azepin-1-yl)-8-chloro-1-cyclopropyl-6-fluoro-1,4-dihydro-4-oxo-, Monohydrochloride

    19. 7-[(3r)-3-aminoazepan-1-yl]-8-chloro-1-cyclopropyl-6-fluoro-4-oxoquinoline-3-carboxylic Acid;hydrochloride

    20. Bol 303224a

    21. Besivance (tn)

    22. Besivance Hydrochloride

    23. 7-[(3r)-3-aminohexahydro-1h-azepin-1-yl]-8-chloro-1-cyclopropyl-6-fluoro-1,4-dihydro-4-oxo-3-quinolinecarboxylic Acid Hydrochloride

    24. Schembl291598

    25. Chembl1201761

    26. Dtxsid20193529

    27. Besifloxacin Hydrochloride- Bio-x

    28. Amy18155

    29. Ex-a1339

    30. Mfcd14636632

    31. S3055

    32. Akos025401618

    33. Besifloxacin Hydrochloride [mi]

    34. Ccg-221259

    35. Cs-0713

    36. Ac-23367

    37. Bb164241

    38. Besifloxacin Hydrochloride [mart.]

    39. Besifloxacin Hydrochloride [vandf]

    40. Hy-17028

    41. Besifloxacin Hydrochloride [who-dd]

    42. Besifloxacin Hydrochloride [orange Book]

    43. C75052

    44. D08872

    45. 165b619

    46. A848253

    47. J-519840

    48. Q27266315

    49. Besifloxacin Hydrochloride 100 Microg/ml In Acetonitrile:water

    50. (r)-7-(3-aminohexahydro-1h-azepin-1-yl)-8-chloro-1-cyclopropyl-6-fluoro-1,4-dihydro-4-oxo-3-quinolinecarboxylic Acid Hydrochloride

    2.4 Create Date
    2006-10-25
    3 Chemical and Physical Properties
    Molecular Weight 430.3 g/mol
    Molecular Formula C19H22Cl2FN3O3
    Hydrogen Bond Donor Count3
    Hydrogen Bond Acceptor Count7
    Rotatable Bond Count3
    Exact Mass429.1022251 g/mol
    Monoisotopic Mass429.1022251 g/mol
    Topological Polar Surface Area86.9 Ų
    Heavy Atom Count28
    Formal Charge0
    Complexity656
    Isotope Atom Count0
    Defined Atom Stereocenter Count1
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count2
    4 Pharmacology and Biochemistry
    4.1 MeSH Pharmacological Classification

    Anti-Bacterial Agents

    Substances that inhibit the growth or reproduction of BACTERIA. (See all compounds classified as Anti-Bacterial Agents.)

    Topoisomerase II Inhibitors

    Compounds that inhibit the activity of DNA TOPOISOMERASE II. Included in this category are a variety of ANTINEOPLASTIC AGENTS which target the eukaryotic form of topoisomerase II and ANTIBACTERIAL AGENTS which target the prokaryotic form of topoisomerase II. (See all compounds classified as Topoisomerase II Inhibitors.)

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