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    Chemistry

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    Also known as: 1315449-72-9, Lci699-aza, Unii-y6581yaw9v, Osilodrostat phosphate [usan], Y6581yaw9v, Isturisa
    Molecular Formula
    C13H13FN3O4P
    Molecular Weight
    325.23  g/mol
    InChI Key
    FMCPYRDGUZBOJZ-BTQNPOSSSA-N
    FDA UNII
    Y6581YAW9V
    Osilodrostat Phosphate
    1 2D Structure

    Osilodrostat Phosphate

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    4-[(5R)-6,7-dihydro-5H-pyrrolo[1,2-c]imidazol-5-yl]-3-fluorobenzonitrile;phosphoric acid
    2.1.2 InChI
    InChI=1S/C13H10FN3.H3O4P/c14-12-5-9(6-15)1-3-11(12)13-4-2-10-7-16-8-17(10)13;1-5(2,3)4/h1,3,5,7-8,13H,2,4H2;(H3,1,2,3,4)/t13-;/m1./s1
    2.1.3 InChI Key
    FMCPYRDGUZBOJZ-BTQNPOSSSA-N
    2.1.4 Canonical SMILES
    C1CC2=CN=CN2C1C3=C(C=C(C=C3)C#N)F.OP(=O)(O)O
    2.1.5 Isomeric SMILES
    C1CC2=CN=CN2[C@H]1C3=C(C=C(C=C3)C#N)F.OP(=O)(O)O
    2.2 Other Identifiers
    2.2.1 UNII
    Y6581YAW9V
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. (+)-osilodrostat

    2. 4-((5r)-6,7-dihydro-5h-pyrrolo(1,2-c)imidazol-5-yl)-3-fluoro-benzonitrile

    3. Benzonitrile, 4-((5r)-6,7-dihydro-5h-pyrrolo(1,2-c)imidazol-5-yl)-3-fluoro-

    4. Isturisa

    5. Lci699

    6. Osilodrostat

    2.3.2 Depositor-Supplied Synonyms

    1. 1315449-72-9

    2. Lci699-aza

    3. Unii-y6581yaw9v

    4. Osilodrostat Phosphate [usan]

    5. Y6581yaw9v

    6. Isturisa

    7. Osilodrostat(lci699) Phosphate

    8. Osilodrostat (phosphate)

    9. 4-((5r)-6,7-dihydro-5h-pyrrolo(1,2-c)imidazol-5-yl)-3-fluorobenzonitrile Dihydrogen Phosphate

    10. 4-[(5r)-6,7-dihydro-5h-pyrrolo[1,2-c]imidazol-5-yl]-3-fluorobenzonitrile;phosphoric Acid

    11. Benzonitrile, 4-((5r)-6,7-dihydro-5h-pyrrolo(1,2-c)imidazol-5-yl)-3-fluoro-, Phosphate (1:1)

    12. Isturisa (tn)

    13. 4-[(5r)-6,7-dihydro-5h-pyrrolo[1,2-c]imidazol-5-yl]-3-fluorobenzonitrile Dihydrogen Phosphate

    14. Chembl3707393

    15. Schembl13837602

    16. Dtxsid401027857

    17. Osilodrostat Phosphate [mi]

    18. Osilodrostat Phosphate (jan/usan)

    19. Osilodrostat Phosphate [jan]

    20. Hy-16276a

    21. Akos040749099

    22. Osilodrostat Phosphate [who-dd]

    23. Da-76469

    24. Osilodrostat Phosphate [orange Book]

    25. Cs-0068058

    26. D11062

    27. Q27294304

    28. 4-((5r)-6,7-dihydro-5h-pyrrolo(1,2-c)imidazol-5-yl)-3-fluorobenzonitrile Monophosphate

    2.3.3 Other Synonyms

    1. Lci699

    2. Osilodrostat

    3. Osilodrostat (lci699)

    4. Osilodrostat Free Base

    2.4 Create Date
    2013-03-21
    3 Chemical and Physical Properties
    Molecular Weight 325.23 g/mol
    Molecular Formula C13H13FN3O4P
    Hydrogen Bond Donor Count3
    Hydrogen Bond Acceptor Count7
    Rotatable Bond Count1
    Exact Mass g/mol
    Monoisotopic Mass g/mol
    Topological Polar Surface Area119
    Heavy Atom Count22
    Formal Charge0
    Complexity387
    Isotope Atom Count0
    Defined Atom Stereocenter Count1
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count2
    4 Drug and Medication Information
    4.1 Drug Indication

    Isturisa is indicated for the treatment of endogenous Cushing's syndrome in adults.

    5 Pharmacology and Biochemistry
    5.1 ATC Code

    H02CA02

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