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    MK2206

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    2D Structure
    Also known as: 1032350-13-2, Mk-2206 2hcl, Mk2206, 8-(4-(1-aminocyclobutyl)phenyl)-9-phenyl-[1,2,4]triazolo[3,4-f][1,6]naphthyridin-3(2h)-one dihydrochloride, 8-[4-(1-aminocyclobutyl)phenyl]-9-phenyl-1,2,4-triazolo[3,4-f][1,6]naphthyridin-3(2h)-one dihydrochloride, Q34i3e28io
    Molecular Formula
    C25H23Cl2N5O
    Molecular Weight
    480.4  g/mol
    InChI Key
    HWUHTJIKQZZBRA-UHFFFAOYSA-N
    FDA UNII
    Q34I3E28IO
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    8-[4-(1-aminocyclobutyl)phenyl]-9-phenyl-2H-[1,2,4]triazolo[3,4-f][1,6]naphthyridin-3-one;dihydrochloride
    2.1.2 InChI
    InChI=1S/C25H21N5O.2ClH/c26-25(12-4-13-25)18-9-7-17(8-10-18)22-19(16-5-2-1-3-6-16)15-20-21(27-22)11-14-30-23(20)28-29-24(30)31;;/h1-3,5-11,14-15H,4,12-13,26H2,(H,29,31);2*1H
    2.1.3 InChI Key
    HWUHTJIKQZZBRA-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C1CC(C1)(C2=CC=C(C=C2)C3=C(C=C4C(=N3)C=CN5C4=NNC5=O)C6=CC=CC=C6)N.Cl.Cl
    2.2 Other Identifiers
    2.2.1 UNII
    Q34I3E28IO
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. Mk 2206

    2. Mk-2206

    3. Mk2206

    2.3.2 Depositor-Supplied Synonyms

    1. 1032350-13-2

    2. Mk-2206 2hcl

    3. Mk2206

    4. 8-(4-(1-aminocyclobutyl)phenyl)-9-phenyl-[1,2,4]triazolo[3,4-f][1,6]naphthyridin-3(2h)-one Dihydrochloride

    5. 8-[4-(1-aminocyclobutyl)phenyl]-9-phenyl-1,2,4-triazolo[3,4-f][1,6]naphthyridin-3(2h)-one Dihydrochloride

    6. Q34i3e28io

    7. 8-[4-(1-aminocyclobutyl)phenyl]-9-phenyl-2h-[1,2,4]triazolo[3,4-f][1,6]naphthyridin-3-one;dihydrochloride

    8. 1,2,4-triazolo(3,4-f)(1,6)naphthyridin-3(2h)-one, 8-(4-(1-aminocyclobutyl)phenyl)-9-phenyl-, Hydrochloride (1:2)

    9. Mk-2206 Hcl Salt

    10. Unii-q34i3e28io

    11. Mk 2206 2hcl

    12. 1032349-77-1

    13. Mk 2206 Dihydrochloride

    14. Chembl4635254

    15. Schembl17100521

    16. Ex-a259

    17. Mfcd14584463

    18. S1078

    19. Akos015966903

    20. Ccg-264809

    21. Pb19401

    22. 8-[4-(1-aminocyclobutyl)phenyl]-9-phenyl-2h-[1,2,4]triazolo[3,4-f][1,6]naphthyridin-3-one;dihydrochl

    23. Ac-28437

    24. As-16298

    25. Ft-0672430

    26. Sw202557-3

    27. P11738

    28. J-000912

    29. J-519356

    30. Q27286944

    31. (2r,4s)-4-[(3-carboxy-1-oxopropyl)amino]-4-[(p-phenylphenyl)methyl]-2-methylbutanoic Acid Ethyl Ester

    32. 4-[[(2s,4r)-5-ethoxy-4-methyl-5-oxo-1-(4-phenylphenyl)pentan-2-yl]amino]-4-oxobutanoic Acid Calcium Salt

    33. 4-{[(2s,4r)-1-(4-biphenylyl)-5-ethoxy-4-methyl-5-oxo-2-pentanyl]amino}-4-oxobutanoic Acid

    34. 8-[4-(1-aminocyclobutyl)phenyl]-9-phenyl-1,2,4-triazolo[3,4-f][1,6]naphthyridin-3(2h)-one 2hcl

    2.4 Create Date
    2010-11-02
    3 Chemical and Physical Properties
    Molecular Weight 480.4 g/mol
    Molecular Formula C25H23Cl2N5O
    Hydrogen Bond Donor Count4
    Hydrogen Bond Acceptor Count4
    Rotatable Bond Count3
    Exact Mass479.1279658 g/mol
    Monoisotopic Mass479.1279658 g/mol
    Topological Polar Surface Area83.6 Ų
    Heavy Atom Count33
    Formal Charge0
    Complexity760
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count3
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