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    Vipoglanstat

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    2D Structure
    Also known as: 1360622-01-0, Gs-248, Fn57bdr4da, 1h-benzimidazole-5-carboxamide, 2-((2,6-dichloro-3-(((2,2-dimethyl-1-oxopropyl)amino)methyl)phenyl)amino)-6-(2,2-difluoroethoxy)-1-methyl-n-(trans-4-(trifluoromethyl)cyclohexyl)-, 2-((2,6-dichloro-3-(((2,2-dimethyl-1-oxopropyl)amino)methyl)phenyl)amino)-6-(2,2-difluoroethoxy)-1-methyl-n-(trans-4-(trifluoromethyl)cyclohexyl)-1h-benzimidazole-5-carboxamide, Vipoglanstat [inn]
    Molecular Formula
    C30H34Cl2F5N5O3
    Molecular Weight
    678.5  g/mol
    InChI Key
    PFORUFFGGNOLPJ-UHFFFAOYSA-N
    FDA UNII
    FN57BDR4DA
    VIPOGLANSTAT is a small molecule drug with a maximum clinical trial phase of II (across all indications) and has 2 investigational indications.
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    2-[2,6-dichloro-3-[(2,2-dimethylpropanoylamino)methyl]anilino]-6-(2,2-difluoroethoxy)-1-methyl-N-[4-(trifluoromethyl)cyclohexyl]benzimidazole-5-carboxamide
    2.1.2 InChI
    InChI=1S/C30H34Cl2F5N5O3/c1-29(2,3)27(44)38-13-15-5-10-19(31)25(24(15)32)41-28-40-20-11-18(22(45-14-23(33)34)12-21(20)42(28)4)26(43)39-17-8-6-16(7-9-17)30(35,36)37/h5,10-12,16-17,23H,6-9,13-14H2,1-4H3,(H,38,44)(H,39,43)(H,40,41)
    2.1.3 InChI Key
    PFORUFFGGNOLPJ-UHFFFAOYSA-N
    2.2 Other Identifiers
    2.2.1 UNII
    FN57BDR4DA
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. 1360622-01-0

    2. Gs-248

    3. Fn57bdr4da

    4. 1h-benzimidazole-5-carboxamide, 2-((2,6-dichloro-3-(((2,2-dimethyl-1-oxopropyl)amino)methyl)phenyl)amino)-6-(2,2-difluoroethoxy)-1-methyl-n-(trans-4-(trifluoromethyl)cyclohexyl)-

    5. 2-((2,6-dichloro-3-(((2,2-dimethyl-1-oxopropyl)amino)methyl)phenyl)amino)-6-(2,2-difluoroethoxy)-1-methyl-n-(trans-4-(trifluoromethyl)cyclohexyl)-1h-benzimidazole-5-carboxamide

    6. Vipoglanstat [inn]

    7. Unii-fn57bdr4da

    8. Bi-1029539

    9. Orb1738606

    10. Chembl3694493

    11. Schembl10169877

    12. Schembl11970119

    13. Schembl29589517

    14. Schembl30789348

    15. Gtpl12209

    16. Pforuffggnolpj-qaqduykdsa-n

    17. Bdbm124265

    18. Gs248

    19. Da-78897

    20. Ms-31082

    21. Bi1029539

    22. Hy-147416

    23. Bi 1029539

    24. Cs-0564159

    25. Us8759537, 1

    26. 2-((2,6-dichloro-3-(pivalamidomethyl)phenyl)amino)-6-(2,2-difluoroethoxy)-1-methyl-n-(trans-4-(trifluoromethyl)cyclohexyl)-1h-benzo[d]imidazole-5-carboxamide

    27. 2-[2,6-dichloro-3-[(2,2-dimethylpropanoylamino)methyl]anilino]-6-(2,2-difluoroethoxy)-1-methyl-n-[4-(trifluoromethyl)cyclohexyl]benzimidazole-5-carboxamide

    28. 2-{2,6-dichloro-3-[(2,2-dimethylpropanamido)methyl]anilino}-6-(2,2-difluoroethoxy)-1-methyl-n-[trans-4-(trifluoromethyl)cyclohexyl]-1h-benzimidazole-5-carboxamide

    2.4 Create Date
    2012-03-05
    3 Chemical and Physical Properties
    Molecular Weight 678.5 g/mol
    Molecular Formula C30H34Cl2F5N5O3
    XLogP37.8
    Hydrogen Bond Donor Count3
    Hydrogen Bond Acceptor Count10
    Rotatable Bond Count10
    Exact Mass Da
    Monoisotopic Mass Da
    Topological Polar Surface Area97.3
    Heavy Atom Count45
    Formal Charge0
    Complexity1010
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
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