loader
Please Wait
Applying Filters...
menu
    • menu

    Technical details about Roluperidone Hydrochloride, learn more about the structure, uses, toxicity, action, side effects and more

    Client Email Product
    EUROAPI, the leading small molecules API player, provides both API sales & CDMO services.

    Virtual Booth

    Contact Supplier

    Bora Pharmaceuticals- Making success more certain.

    Virtual Booth

    Contact Supplier

    Polfa Tarchomin is a leading Polish pharmaceutical company with 200 year tradition in manufacture and sale of pharmaceutical products.

    Virtual Booth

    Contact Supplier

    Minakem offers CDMO services for API & HPAPI, generics, regulatory expertise, track record performance & FDA & GMP certifications.

    Virtual Booth

    Contact Supplier

    Axplora- The partner of choice for complex APIs.

    Virtual Booth

    Contact Supplier

    Fareva is a one-stop-shop for API/HPAPI, OSD & Sterile products, is USFDA, EMA and PMDA-inspected and has multiple NDA & ANDA filings.

    Virtual Booth

    Contact Supplier

    Menu

    Roluperidone Hydrochloride

    ACTIVE PHARMA INGREDIENTS

    DEVELOPMENTS

    DIGITAL CONTENT

    PharmaCompass
    Xls

    Filters

    clear-filterReset all filters
    2D Structure
    Also known as: 359625-79-9, Cyr-101, Min-101, Min-101 free base, 4p31i0m3bf, 2-((1-(2-(4-fluorophenyl)-2-oxoethyl)piperidin-4-yl)methyl)isoindolin-1-one
    Molecular Formula
    C22H23FN2O2
    Molecular Weight
    366.4  g/mol
    InChI Key
    RNRYULFRLCBRQS-UHFFFAOYSA-N
    FDA UNII
    4P31I0M3BF
    Roluperidone has been used in trials studying the treatment of Schizophrenia.
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    2-[[1-[2-(4-fluorophenyl)-2-oxoethyl]piperidin-4-yl]methyl]-3H-isoindol-1-one
    2.1.2 InChI
    InChI=1S/C22H23FN2O2/c23-19-7-5-17(6-8-19)21(26)15-24-11-9-16(10-12-24)13-25-14-18-3-1-2-4-20(18)22(25)27/h1-8,16H,9-15H2
    2.1.3 InChI Key
    RNRYULFRLCBRQS-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C1CN(CCC1CN2CC3=CC=CC=C3C2=O)CC(=O)C4=CC=C(C=C4)F
    2.2 Other Identifiers
    2.2.1 UNII
    4P31I0M3BF
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. Min-101

    2. Roluperidone Hydrochloride

    2.3.2 Depositor-Supplied Synonyms

    1. 359625-79-9

    2. Cyr-101

    3. Min-101

    4. Min-101 Free Base

    5. 4p31i0m3bf

    6. 2-((1-(2-(4-fluorophenyl)-2-oxoethyl)piperidin-4-yl)methyl)isoindolin-1-one

    7. Roluperidone (usan)

    8. Roluperidone [usan]

    9. 1h-isoindol-1-one, 2-((1-(2-(4-fluorophenyl)-2-oxoethyl)-4-piperidinyl)methyl)-2,3-dihydro-

    10. Unii-4p31i0m3bf

    11. Roluperidon

    12. 2-((1-(2-(4-fluorophenyl)-2-oxoethyl)piperidin-4-yl)methyl)-2,3-dihydro-1h-isoindol-1-one

    13. 2-({1-[2-(4-fluorophenyl)-2-oxoethyl]piperidin-4-yl}methyl)-2,3-dihydro-1h-isoindol-1-one

    14. Cyr-101(roluperidone)

    15. Roluperidone; Cyr-101

    16. Roluperidone [inn]

    17. Schembl5252391

    18. Chembl4297605

    19. Dtxsid10189512

    20. Mt-210cyr-101

    21. Ex-a3145

    22. Mfcd28502826

    23. Akos037643756

    24. Cs-6971

    25. Db13080

    26. As-35144

    27. Hy-19469

    28. Db-086934

    29. D11258

    30. A1-49962

    31. Q25100536

    32. 2-[[1-[2-(4-fluorophenyl)-2-oxoethyl]piperidin-4-yl]methyl]-3h-isoindol-1-one

    33. 2-({1-[2-(4-fluorophenyl)-2-oxoethyl]piperidin-4-yl}methyl)-2,3-dihydro-1h-isoindol-1-one; Min-101

    34. 2-[[1-[2-(4-fluorophenyl)-2-oxoethyl]-4-piperidinyl]methyl]-2,3-dihydro-1h-isoindol-1-one

    35. Yt7

    2.4 Create Date
    2006-10-25
    3 Chemical and Physical Properties
    Molecular Weight 366.4 g/mol
    Molecular Formula C22H23FN2O2
    XLogP33.2
    Hydrogen Bond Donor Count0
    Hydrogen Bond Acceptor Count4
    Rotatable Bond Count5
    Exact Mass366.17435614 g/mol
    Monoisotopic Mass366.17435614 g/mol
    Topological Polar Surface Area40.6 Ų
    Heavy Atom Count27
    Formal Charge0
    Complexity538
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1