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    Chemistry

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    Also known as: Akrinol, 7527-91-5, Sch 7056, 1,3-benzenediol, 4-hexyl-, compd. with 9-acridinamine (1:1), Nsc-758691, 4-hexylresorcinol compound with 9-aminoacridine (1:1)
    Molecular Formula
    C25H28N2O2
    Molecular Weight
    388.5  g/mol
    InChI Key
    YZODJQFXMFEJRM-UHFFFAOYSA-N
    FDA UNII
    2U918O4BEV
    Acrisorcin
    Acrisorcin is a topical anti-fungal agent. Acrisorcin is comprised of two active ingredients, 9-aminoacridine and 4-hexylresorcinol, but its clinical use has been discontinued.
    1 2D Structure

    Acrisorcin

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    acridin-9-amine;4-hexylbenzene-1,3-diol
    2.1.2 InChI
    InChI=1S/C13H10N2.C12H18O2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13;1-2-3-4-5-6-10-7-8-11(13)9-12(10)14/h1-8H,(H2,14,15);7-9,13-14H,2-6H2,1H3
    2.1.3 InChI Key
    YZODJQFXMFEJRM-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CCCCCCC1=C(C=C(C=C1)O)O.C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)N
    2.2 Other Identifiers
    2.2.1 UNII
    2U918O4BEV
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. Akrinol

    2. 7527-91-5

    3. Sch 7056

    4. 1,3-benzenediol, 4-hexyl-, Compd. With 9-acridinamine (1:1)

    5. Nsc-758691

    6. 4-hexylresorcinol Compound With 9-aminoacridine (1:1)

    7. 2u918o4bev

    8. Acrosorcin; Akrinol; Sch 7056

    9. Sch-7056

    10. Acrisorcina

    11. Acrisorcinum

    12. Acrisorcinum [inn-latin]

    13. Acrisorcina [inn-spanish]

    14. Einecs 231-389-7

    15. Unii-2u918o4bev

    16. Acrisorcin [usan:usp:inn]

    17. Bis(9-aminoacridinium)salz Des Hexylresorcine

    18. Bis(9-aminoacridinium 4-hexyl-1,3-resorcindiolat

    19. Akrinol (tn)

    20. 9-aminoacridine Compd. With 4-hexylresorcinol (1:1)

    21. Spectrum_000107

    22. Acrisorcin [mi]

    23. Specplus_000886

    24. Acrisorcin [inn]

    25. Acrisorcin (usan/inn)

    26. Spectrum2_001107

    27. Spectrum3_001213

    28. Spectrum4_000625

    29. Spectrum5_001392

    30. Acrisorcin [usan]

    31. Acrisorcin [mart.]

    32. Bspbio_002626

    33. Kbiogr_001210

    34. Kbioss_000547

    35. Divk1c_006982

    36. Schembl148836

    37. Spectrum1504218

    38. Spbio_001214

    39. Acrisorcin [orange Book]

    40. Chembl1201038

    41. Kbio1_001926

    42. Kbio2_000547

    43. Kbio2_003115

    44. Kbio2_005683

    45. Kbio3_002126

    46. Dtxsid10226234

    47. Hms1922h03

    48. Hms2093c18

    49. Pharmakon1600-01504218

    50. Ccg-40100

    51. Nsc758691

    52. Nsc 758691

    53. Ncgc00095115-01

    54. Ncgc00095115-02

    55. Ncgc00095115-03

    56. Acridin-9-amine;4-hexylbenzene-1,3-diol

    57. Sbi-0052753.p002

    58. D02759

    59. Ab00053836_02

    60. Sr-05000001975

    61. Q4675133

    62. Sr-05000001975-1

    63. Brd-m49658242-001-02-5

    64. Brd-m49658242-001-03-3

    2.4 Create Date
    2005-08-08
    3 Chemical and Physical Properties
    Molecular Weight 388.5 g/mol
    Molecular Formula C25H28N2O2
    Hydrogen Bond Donor Count3
    Hydrogen Bond Acceptor Count4
    Rotatable Bond Count5
    Exact Mass388.215078140 g/mol
    Monoisotopic Mass388.215078140 g/mol
    Topological Polar Surface Area79.4 Ų
    Heavy Atom Count29
    Formal Charge0
    Complexity354
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count2

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