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    Technical details about Prestwick3_000367, learn more about the structure, uses, toxicity, action, side effects and more

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    Prestwick3_000367

    APIs // Active Pharmaceutical Ingredients

    PharmaCompass

    Phyton is a World Leader in Plant Cell Fermentation Technology and Commercial Manufacturing.

    Athena Pharmaceutiques is a Partner of Choice for Drug Delivery & Life Cycle Management.

    2D Structure
    1. Also known as: 23602-78-0, Benfluramate, Mediator, Minolip, N-(2-benzoyloxyethyl)norfenfluramine, Mediaxal
    Molecular Formula
    C19H20F3NO2
    Molecular Weight
    351.4  g/mol
    InChI Key
    CJAVTWRYCDNHSM-UHFFFAOYSA-N
    FDA UNII
    403FO0NQG3
    Benfluorex is an antilipidemic agent that decreases the relative rate of hepatic triacylglycerol synthesis. Benfluorex was never approved for use in the United States and was withdrawn in the European Union because of an increased risk of pulmonary hypertension and valvular disease.
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    2-[1-[3-(trifluoromethyl)phenyl]propan-2-ylamino]ethyl benzoate
    2.1.2 InChI
    InChI=1S/C19H20F3NO2/c1-14(12-15-6-5-9-17(13-15)19(20,21)22)23-10-11-25-18(24)16-7-3-2-4-8-16/h2-9,13-14,23H,10-12H2,1H3
    2.1.3 InChI Key
    CJAVTWRYCDNHSM-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CC(CC1=CC(=CC=C1)C(F)(F)F)NCCOC(=O)C2=CC=CC=C2
    2.2 Other Identifiers
    2.2.1 UNII
    403FO0NQG3
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. 1-(2-trifluoromethylphenyl)-2-(benzoyloxyethyl)aminopropane Hcl

    2. 780 Se

    3. Benfluorex Hydrochloride

    4. Benfluorex Hydrochloride, (+-)-isomer

    5. Benfluorex Maleate

    6. Benfluorex, Methanesulfonate Salt

    7. Benfluramate

    8. Jp 992

    9. S 780

    10. Se 780

    2.3.2 Depositor-Supplied Synonyms

    1. 23602-78-0

    2. Benfluramate

    3. Mediator

    4. Minolip

    5. N-(2-benzoyloxyethyl)norfenfluramine

    6. Mediaxal

    7. Jp 992

    8. 403fo0nqg3

    9. Nsc-757396

    10. Benfluorexum

    11. 2-((1-(3-(trifluoromethyl)phenyl)propan-2-yl)amino)ethyl Benzoate

    12. Benfluorexum [inn-latin]

    13. Ethanol, 2-[[1-methyl-2-[3-(trifluoromethyl)phenyl]ethyl]amino]-, Benzoate

    14. Ethanol, 2-[[1-methyl-2-[3-(trifluoromethyl)phenyl]ethyl]amino]-, Benzoate(ester)

    15. Se 780

    16. Smr000857234

    17. 2-((alpha-methyl-m-(trifluoromethyl)phenethyl)amino)ethanol Benzoate (ester)

    18. Einecs 245-777-9

    19. Brn 4152887

    20. Unii-403fo0nqg3

    21. Benflurorex

    22. Benfluorex [inn:ban:dcf]

    23. Mediaxal (tn)

    24. Spectrum_000272

    25. Benfluorex [mi]

    26. 2-(alpha-methyl-m-trifluoromethylphenethylamino)ethanol Benzoate

    27. Benfluorex (inn/ban)

    28. Benfluorex [inn]

    29. Prestwick0_000367

    30. Prestwick1_000367

    31. Prestwick2_000367

    32. Prestwick3_000367

    33. Spectrum2_001217

    34. Spectrum3_001383

    35. Spectrum4_000806

    36. Spectrum5_001421

    37. N-(2-hydroxyethyl)-alpha-methyl-m-trifluoromethylphenethylamine Benzoate

    38. Phenethylamine, N-(2-hydroxyethyl)-alpha-methyl-m-trifluoromethyl-, Benzoate

    39. Benfluorex [who-dd]

    40. Benfluorexhydrochloride

    41. Bspbio_000493

    42. Bspbio_002966

    43. Kbiogr_001291

    44. Kbioss_000752

    45. Mls001333109

    46. Mls001333110

    47. Divk1c_000033

    48. Schembl163648

    49. Spbio_001034

    50. Spbio_002414

    51. Bpbio1_000543

    52. Chembl400599

    53. Dtxsid5048471

    54. Chebi:93826

    55. Hy-b1058a

    56. Kbio1_000033

    57. Kbio2_000752

    58. Kbio2_003320

    59. Kbio2_005888

    60. Kbio3_002186

    61. Ninds_000033

    62. Hms2230n21

    63. Hms3373e17

    64. Hms3713i15

    65. 2-[1-[3-(trifluoromethyl)phenyl]propan-2-ylamino]ethyl Benzoate

    66. 2-({1-methyl-2-[3-(trifluoromethyl)phenyl]ethyl}amino)ethyl Benzoate

    67. Jp-992

    68. Se-780

    69. Akos024319409

    70. Ethanol, 2-(alpha-methyl-m-trifluoromethylphenethylamino)-, Benzoate

    71. Ccg-220367

    72. Db09022

    73. Nsc 757396

    74. Idi1_000033

    75. Ncgc00178369-01

    76. Ncgc00178369-02

    77. Sbi-0051587.p002

    78. Ab00053576

    79. Cs-0013373

    80. S-780

    81. D07192

    82. Ab00053576_13

    83. Q421695

    84. Brd-a22305049-003-05-2

    85. Brd-a22305049-003-08-6

    86. 2-(.alpha.-methyl-m-trifluoromethylphenethylamino)ethanol Benzoate

    87. 2-((1-methyl-2-[3-(trifluoromethyl)phenyl]ethyl)amino)ethyl Benzoate #

    88. Benzoic Acid 2-[1-[3-(trifluoromethyl)phenyl]propan-2-ylamino]ethyl Ester

    89. Ethanol, 2-(.alpha.-methyl-m-trifluoromethylphenethylamino)-, Benzoate

    90. N-(2-hydroxyethyl)-.alpha.-methyl-m-trifluoromethylphenethylamine Benzoate

    91. 2-[[.alpha.-methyl-m-(trifluoromethyl)phenethyl]amino]ethanol Benzoate (ester)

    92. Phenethylamine, N-(2-hydroxyethyl)-.alpha.-methyl-m-trifluoromethyl-, Benzoate

    2.4 Create Date
    2005-03-25
    3 Chemical and Physical Properties
    Molecular Weight 351.4 g/mol
    Molecular Formula C19H20F3NO2
    XLogP34.6
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count6
    Rotatable Bond Count8
    Exact Mass351.14461337 g/mol
    Monoisotopic Mass351.14461337 g/mol
    Topological Polar Surface Area38.3 Ų
    Heavy Atom Count25
    Formal Charge0
    Complexity408
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count1
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
    4 Pharmacology and Biochemistry
    4.1 MeSH Pharmacological Classification

    Appetite Depressants

    Agents that are used to suppress appetite. (See all compounds classified as Appetite Depressants.)

    Hypolipidemic Agents

    Substances that lower the levels of certain LIPIDS in the BLOOD. They are used to treat HYPERLIPIDEMIAS. (See all compounds classified as Hypolipidemic Agents.)

    4.2 ATC Code

    A - Alimentary tract and metabolism

    A10 - Drugs used in diabetes

    A10B - Blood glucose lowering drugs, excl. insulins

    A10BX - Other blood glucose lowering drugs, excl. insulins

    A10BX06 - Benfluorex

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