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    Aficamten

    ACTIVE PHARMA INGREDIENTS

    DEVELOPMENTS

    FINISHED DOSAGE FORMULATIONS

    DIGITAL CONTENT

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    2D Structure
    Also known as: Aficamten [inn], Aficamten [usan], 2364554-48-1, B1i77mh6k1, Chembl4847050, Ck-3773274
    Molecular Formula
    C18H19N5O2
    Molecular Weight
    337.4  g/mol
    InChI Key
    IOVAZWDIRCRMTM-OAHLLOKOSA-N
    FDA UNII
    B1I77MH6K1
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    N-[(1R)-5-(5-ethyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-inden-1-yl]-1-methylpyrazole-4-carboxamide
    2.1.2 InChI
    InChI=1S/C18H19N5O2/c1-3-16-21-17(22-25-16)12-4-6-14-11(8-12)5-7-15(14)20-18(24)13-9-19-23(2)10-13/h4,6,8-10,15H,3,5,7H2,1-2H3,(H,20,24)/t15-/m1/s1
    2.1.3 InChI Key
    IOVAZWDIRCRMTM-OAHLLOKOSA-N
    2.1.4 Canonical SMILES
    CCC1=NC(=NO1)C2=CC3=C(C=C2)C(CC3)NC(=O)C4=CN(N=C4)C
    2.1.5 Isomeric SMILES
    CCC1=NC(=NO1)C2=CC3=C(C=C2)[C@@H](CC3)NC(=O)C4=CN(N=C4)C
    2.2 Other Identifiers
    2.2.1 UNII
    B1I77MH6K1
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. Aficamten [inn]

    2. Aficamten [usan]

    3. 2364554-48-1

    4. B1i77mh6k1

    5. Chembl4847050

    6. Ck-3773274

    7. 1h-pyrazole-4-carboxamide, N-((1r)-5-(5-ethyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1h-inden-1-yl)-1-methyl-

    8. N-((1r)-5-(5-ethyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1h-inden-1-yl)- 1-methyl-1h-pyrazole-4-carboxamide

    9. Unii-b1i77mh6k1

    10. Schembl21179170

    11. Gtpl11524

    12. Ex-a5344

    13. Bdbm50575173

    14. Ck-274

    15. Who 11544

    16. Ck3773274

    17. Hy-139465

    18. Ck-3773274;ck-274

    19. Cs-0202223

    20. (r)-n-(5-(5-ethyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1h-inden-1-yl)-1-methyl-1h-pyrazole-4-carboxamide

    21. N-[(1r)-5-(5-ethyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1h-inden-1-yl]-1-methylpyrazole-4-carboxamide

    2.4 Create Date
    2019-11-02
    3 Chemical and Physical Properties
    Molecular Weight 337.4 g/mol
    Molecular Formula C18H19N5O2
    XLogP32.1
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count5
    Rotatable Bond Count4
    Exact Mass337.15387487 g/mol
    Monoisotopic Mass337.15387487 g/mol
    Topological Polar Surface Area85.8 Ų
    Heavy Atom Count25
    Formal Charge0
    Complexity490
    Isotope Atom Count0
    Defined Atom Stereocenter Count1
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
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