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    Miricorilant

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    DIGITAL CONTENT

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    2D Structure
    Also known as: Cort118335, Miricorilant [inn], Miricorilant [usan], Cort-118335, Chembl2204043, 311y5gv21m
    Molecular Formula
    C24H23F3N2O2
    Molecular Weight
    428.4  g/mol
    InChI Key
    GVVUZBSCYAVFTI-UHFFFAOYSA-N
    FDA UNII
    311Y5GV21M
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    6-(4-phenylcyclohexyl)-5-[[3-(trifluoromethyl)phenyl]methyl]-1H-pyrimidine-2,4-dione
    2.1.2 InChI
    InChI=1S/C24H23F3N2O2/c25-24(26,27)19-8-4-5-15(13-19)14-20-21(28-23(31)29-22(20)30)18-11-9-17(10-12-18)16-6-2-1-3-7-16/h1-8,13,17-18H,9-12,14H2,(H2,28,29,30,31)
    2.1.3 InChI Key
    GVVUZBSCYAVFTI-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C1CC(CCC1C2=CC=CC=C2)C3=C(C(=O)NC(=O)N3)CC4=CC(=CC=C4)C(F)(F)F
    2.2 Other Identifiers
    2.2.1 UNII
    311Y5GV21M
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. C118335

    2. Cort118335

    2.3.2 Depositor-Supplied Synonyms

    1. Cort118335

    2. Miricorilant [inn]

    3. Miricorilant [usan]

    4. Cort-118335

    5. Chembl2204043

    6. 311y5gv21m

    7. 1400902-13-7

    8. 6-(trans-4-phenylcyclohexyl)-5-((3-(trifluoromethyl)phenyl)methyl)-2,4(1h,3h)-pyrimidinedione

    9. Miricorilant (usan/inn)

    10. C118335

    11. Unii-311y5gv21m

    12. Chembl4297602

    13. Schembl12611755

    14. Schembl14789264

    15. Schembl21348606

    16. Gtpl10059

    17. Bdbm50402498

    18. Who 10853

    19. Compound 7 [pmid: 23131342]

    20. Hy-117965

    21. Cs-0068730

    22. D11667

    23. C-118335

    24. 2,4(1h,3h)-pyrimidinedione, 6-(trans-4-phenylcyclohexyl)-5-((3-(trifluoromethyl)phenyl)methyl)-

    25. 6-(trans-4-phenylcyclohexyl)-5-{[3-(trifluoromethyl)phenyl]methyl}pyrimidine-2,4(1h,3h)-dione

    2.4 Create Date
    2012-10-30
    3 Chemical and Physical Properties
    Molecular Weight 428.4 g/mol
    Molecular Formula C24H23F3N2O2
    XLogP35.2
    Hydrogen Bond Donor Count2
    Hydrogen Bond Acceptor Count5
    Rotatable Bond Count4
    Exact Mass428.17116247 g/mol
    Monoisotopic Mass428.17116247 g/mol
    Topological Polar Surface Area58.2 Ų
    Heavy Atom Count31
    Formal Charge0
    Complexity704
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1