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    Ganaplacide

    DEVELOPMENTS

    PharmaCompass
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    2D Structure
    Also known as: Ganaplacide, 1261113-96-5, Kaf-156, Kaf156, Gnf 156, Gnf-156
    Molecular Formula
    C22H23F2N5O
    Molecular Weight
    411.4  g/mol
    InChI Key
    BUPRVECGWBHCQV-UHFFFAOYSA-N
    FDA UNII
    85VMN9JU7A
    Ganaplacide is under investigation in clinical trial NCT03167242 (Efficacy and Safety of KAF156 in Combination With LUM-SDF in Adults and Children With Uncomplicated Plasmodium Falciparum Malaria).
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    2-amino-1-[3-(4-fluoroanilino)-2-(4-fluorophenyl)-8,8-dimethyl-5,6-dihydroimidazo[1,2-a]pyrazin-7-yl]ethanone
    2.1.2 InChI
    InChI=1S/C22H23F2N5O/c1-22(2)21-27-19(14-3-5-15(23)6-4-14)20(26-17-9-7-16(24)8-10-17)28(21)11-12-29(22)18(30)13-25/h3-10,26H,11-13,25H2,1-2H3
    2.1.3 InChI Key
    BUPRVECGWBHCQV-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CC1(C2=NC(=C(N2CCN1C(=O)CN)NC3=CC=C(C=C3)F)C4=CC=C(C=C4)F)C
    2.2 Other Identifiers
    2.2.1 UNII
    85VMN9JU7A
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. 2-amino-1-(2-(4-fluorophenyl)-3-((4-fluorophenyl)amino)-5,6-dihydro-8,8-dimethylimidazo(1,2-a)pyrazin-7(8h)-yl)ethanone

    2. Ganaplacide

    3. Kaf156

    2.3.2 Depositor-Supplied Synonyms

    1. Ganaplacide

    2. 1261113-96-5

    3. Kaf-156

    4. Kaf156

    5. Gnf 156

    6. Gnf-156

    7. Kaf 156

    8. 85vmn9ju7a

    9. Chembl2058833

    10. 2-amino-1-(2-(4-fluorophenyl)-3-((4-fluorophenyl)amino)-5,6-dihydro-8,8-dimethylimidazo(1,2-a)pyrazin-7(8h)-yl)ethanone

    11. 2-amino-1-(2-(4-fluorophenyl)-3-((4-fluorophenyl)amino)-8,8-dimethyl-5,6-dihydroimidazo[1,2-a]pyrazin-7(8h)-yl)ethanone

    12. 2-amino-1-[3-(4-fluoroanilino)-2-(4-fluorophenyl)-8,8-dimethyl-5,6-dihydroimidazo[1,2-a]pyrazin-7-yl]ethanone

    13. Ethanone, 2-amino-1-(2-(4-fluorophenyl)-3-((4-fluorophenyl)amino)-5,6-dihydro-8,8-dimethylimidazo(1,2-a)pyrazin-7(8h)-yl)-

    14. Ganaplacide [inn]

    15. Unii-85vmn9ju7a

    16. Ganaplacide [who-dd]

    17. Gnf156

    18. Gtpl9946

    19. Schembl1047381

    20. Tqr0232

    21. Dtxsid701105307

    22. Bcp21186

    23. Ex-a6670

    24. Bdbm50388532

    25. Mfcd28502124

    26. Akos030629999

    27. Sb17068

    28. As-49356

    29. H11185

    30. A856033

    31. Q28209255

    32. Kaf 156; Kaf156; Gnf-156; Gnf156; Gnf 156; Ganaplacide

    2.4 Create Date
    2011-02-14
    3 Chemical and Physical Properties
    Molecular Weight 411.4 g/mol
    Molecular Formula C22H23F2N5O
    XLogP32.5
    Hydrogen Bond Donor Count2
    Hydrogen Bond Acceptor Count6
    Rotatable Bond Count4
    Exact Mass g/mol
    Monoisotopic Mass g/mol
    Topological Polar Surface Area76.2
    Heavy Atom Count30
    Formal Charge0
    Complexity604
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1