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    Tipepidine

    INTERMEDIATES

    PharmaCompass
    Xls

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    2D Structure
    Also known as: Asverin, 5169-78-8, At 327, 3-(di-2-thienylmethylene)-1-methylpiperidine, Cr/662, Crj662
    Molecular Formula
    C15H17NS2
    Molecular Weight
    275.4  g/mol
    InChI Key
    JWIXXNLOKOAAQT-UHFFFAOYSA-N
    FDA UNII
    2260ZP67IT
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    3-(dithiophen-2-ylmethylidene)-1-methylpiperidine
    2.1.2 InChI
    InChI=1S/C15H17NS2/c1-16-8-2-5-12(11-16)15(13-6-3-9-17-13)14-7-4-10-18-14/h3-4,6-7,9-10H,2,5,8,11H2,1H3
    2.1.3 InChI Key
    JWIXXNLOKOAAQT-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CN1CCCC(=C(C2=CC=CS2)C3=CC=CS3)C1
    2.2 Other Identifiers
    2.2.1 UNII
    2260ZP67IT
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. Tipepidine Citrate (1:1)

    2. Tipepidine Hibenzate

    3. Tipepidine Ibenzato

    2.3.2 Depositor-Supplied Synonyms

    1. Asverin

    2. 5169-78-8

    3. At 327

    4. 3-(di-2-thienylmethylene)-1-methylpiperidine

    5. Cr/662

    6. Crj662

    7. Bitiodin

    8. Tipedine

    9. 2260zp67it

    10. Tipepidine (inn)

    11. At-327

    12. Cr-662

    13. Ncgc00167424-01

    14. Tipepidine [inn]

    15. Tipepidina

    16. Tipepidinum

    17. Tipepidine [inn:dcf]

    18. Tipepidinum [inn-latin]

    19. Tipepidina [inn-spanish]

    20. Brn 0212554

    21. Tipepidin

    22. Unii-2260zp67it

    23. 1-methyl-3-piperidylidenedi(2-thienyl)methane

    24. 3-(di-2-thienylmethylene)-1-methyl-piperidine

    25. 3-(dithiophen-2-ylmethylidene)-1-methylpiperidine

    26. Piperidine, 3-(di-2-thienylmethylene)-1-methyl-

    27. Tipepidine [mi]

    28. Dsstox_cid_2626

    29. Piperidine, 3-(di-2-thienylmethyle)-1-methyl-

    30. Dsstox_rid_82577

    31. Tipepidine [who-dd]

    32. Dsstox_gsid_22626

    33. Oprea1_194078

    34. Oprea1_494302

    35. Cbdive_006087

    36. 4-27-00-06328 (beilstein Handbook Reference)

    37. Schembl410090

    38. Chembl1899506

    39. Dtxsid2022626

    40. Chebi:135141

    41. Tox21_112428

    42. Zinc55161150

    43. Akos000560001

    44. Db13474

    45. Cas-5169-78-8

    46. Hy-121685

    47. Cs-0083052

    48. 3-(di-2-thienylmethylidene)-1-methylpiperidine

    49. D08604

    50. 3-(dithiophen-2-ylmethylene)-1-methylpiperidine

    51. A852039

    52. Q7808816

    2.4 Create Date
    2005-03-25
    3 Chemical and Physical Properties
    Molecular Weight 275.4 g/mol
    Molecular Formula C15H17NS2
    XLogP33.7
    Hydrogen Bond Donor Count0
    Hydrogen Bond Acceptor Count3
    Rotatable Bond Count2
    Exact Mass275.08024189 g/mol
    Monoisotopic Mass275.08024189 g/mol
    Topological Polar Surface Area59.7 Ų
    Heavy Atom Count18
    Formal Charge0
    Complexity309
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
    4 Pharmacology and Biochemistry
    4.1 ATC Code

    R - Respiratory system

    R05 - Cough and cold preparations

    R05D - Cough suppressants, excl. combinations with expectorants

    R05DB - Other cough suppressants

    R05DB24 - Tipepidine