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    Dexfenfluramine

    ACTIVE PHARMA INGREDIENTS

    PharmaCompass
    Xls

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    2D Structure
    Also known as: 3239-45-0, Isomeride, Adipomin, (+)-fenfluramine hydrochloride, Adifax, Redux
    Molecular Formula
    C12H17ClF3N
    Molecular Weight
    267.72  g/mol
    InChI Key
    ZXKXJHAOUFHNAS-FVGYRXGTSA-N
    FDA UNII
    PM28L0FHNP
    The S-isomer of FENFLURAMINE. It is a serotonin agonist and is used as an anorectic. Unlike fenfluramine, it does not possess any catecholamine agonist activity.
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    (2S)-N-ethyl-1-[3-(trifluoromethyl)phenyl]propan-2-amine;hydrochloride
    2.1.2 InChI
    InChI=1S/C12H16F3N.ClH/c1-3-16-9(2)7-10-5-4-6-11(8-10)12(13,14)15;/h4-6,8-9,16H,3,7H2,1-2H3;1H/t9-;/m0./s1
    2.1.3 InChI Key
    ZXKXJHAOUFHNAS-FVGYRXGTSA-N
    2.1.4 Canonical SMILES
    CCNC(C)CC1=CC(=CC=C1)C(F)(F)F.Cl
    2.1.5 Isomeric SMILES
    CCN[C@@H](C)CC1=CC(=CC=C1)C(F)(F)F.Cl
    2.2 Other Identifiers
    2.2.1 UNII
    PM28L0FHNP
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. Dexfenfluramine

    2. Hydrochloride, Dexfenfluramine

    3. Redux

    2.3.2 Depositor-Supplied Synonyms

    1. 3239-45-0

    2. Isomeride

    3. Adipomin

    4. (+)-fenfluramine Hydrochloride

    5. Adifax

    6. Redux

    7. D-fenfluramine Hydrochloride

    8. Glypolix

    9. Dexfenfluramine Hcl

    10. S 5614 Hcl

    11. Dexfenfluramine Hydrochloride [usan]

    12. Pm28l0fhnp

    13. (+)-(s)-n-ethyl-alpha-methyl-m-(trifluoromethyl)phenethylamine Hydrochloride

    14. S-5614 Hcl

    15. Dsstox_cid_28797

    16. Dsstox_rid_83066

    17. Dsstox_gsid_48871

    18. Dexfenfluramine Hydrochloride (usan)

    19. Chebi:59730

    20. Dea No. 1670

    21. Cas-3239-45-0

    22. Ncgc00247710-01

    23. Einecs 221-806-0

    24. Unii-pm28l0fhnp

    25. C12h16f3n.hcl

    26. (s)-(+)-fenfluramine Hydrochloride

    27. Redux (tn)

    28. (s)-n-ethyl-alpha-methyl-m-(trifluoromethyl)phenethylamine Hydrochloride

    29. Mls002320658

    30. Schembl120916

    31. S-5614 Hydrochloride

    32. Chembl1887891

    33. Dtxsid7048871

    34. Dexfenfluramine Hydrochloride- Bio-x

    35. Tox21_112864

    36. Ip-001

    37. Akos024457243

    38. Tox21_112864_1

    39. Ccg-220638

    40. Benzeneethanamine, N-ethyl-alpha-methyl-3-(trifluoromethyl)-, Hydrochloride, (s)-

    41. Fenfluramine D-form Hydrochloride

    42. Ncgc00247710-02

    43. Bf164363

    44. Smr001338809

    45. Dexfenfluramine Hydrochloride [mart.]

    46. Dexfenfluramine Hydrochloride [vandf]

    47. Ft-0653919

    48. Dexfenfluramine Hydrochloride [who-dd]

    49. Fenfluramine D-form Hydrochloride [mi]

    50. D03713

    51. S-5614

    52. 239d450

    53. Sr-01000868883

    54. Sr-01000868883-2

    55. Q27126873

    56. (2s)-n-ethyl-1-[3-(trifluoromethyl)phenyl]propan-2-amine;hydrochloride

    57. (s)-n-ethyl-?-methyl-3-(trifluoromethyl)benzeneethanamine Hydrochloride

    58. (s)-n-ethyl-1-(3-(trifluoromethyl)phenyl)propan-2-amine Hydrochloride

    59. (s)-n-ethyl-a-methyl-3-(trifluoromethyl)benzeneethanamine Hydrochloride

    60. (s)-n-ethyl-alpha-methyl-3-(trifluoromet Hyl)benzeneethanamine Hydrochloride

    61. (+)-(s)-n-ethyl-.alpha.-methyl-m-(trifluoromethyl)phenethylamine Hydrochloride

    62. Benzeneethanamine, N-ethyl-.alpha.-methyl-3-(trifluoromethyl)-, Hydrochloride, (s)-

    63. Benzeneethanamine, N-ethyl-.alpha.-methyl-3-(trifluoromethyl)-, Hydrochloride, (.alpha.s)-

    2.4 Create Date
    2005-08-08
    3 Chemical and Physical Properties
    Molecular Weight 267.72 g/mol
    Molecular Formula C12H17ClF3N
    Hydrogen Bond Donor Count2
    Hydrogen Bond Acceptor Count4
    Rotatable Bond Count4
    Exact Mass267.1001617 g/mol
    Monoisotopic Mass267.1001617 g/mol
    Topological Polar Surface Area12 Ų
    Heavy Atom Count17
    Formal Charge0
    Complexity203
    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

    Serotonin Receptor Agonists

    Endogenous compounds and drugs that bind to and activate SEROTONIN RECEPTORS. Many serotonin receptor agonists are used as ANTIDEPRESSANTS; ANXIOLYTICS; and in the treatment of MIGRAINE DISORDERS. (See all compounds classified as Serotonin Receptor Agonists.)