Please Wait
Applying Filters...
menu
    • menu
    LGM Pharma accelerates & optimizes the new product pathway from early development through commercialization.

    Virtual Booth

    Contact Supplier

    Munit offers scalable GMP micronization and particle size engineering to enhance drug solubility, bioavailability, and performance.

    Virtual Booth

    Contact Supplier

    pharmacompass-1-m-2025-11-03

    Virtual Booth

    An Enquiry

    Mission CDMO team brings reliability, resourcefulness, & responsiveness in executing your development project.

    Virtual Booth

    Contact Supplier

    Jai Radhe Sales is your partner for all your sourcing needs.

    Virtual Booth

    Contact Supplier

    pharmacompass-2-m-2025-11-03

    Virtual Booth

    An Enquiry

    Menu

    Amiselimod

    DEVELOPMENTS

    DIGITAL CONTENT

    PharmaCompass
    Xls

    Filters

    clear-filterReset all filters
    2D Structure
    Also known as: 942399-20-4, Amiselimod [inn], Amiselimod free base, Amiselimod(mt-1303) free base, 942399-20-4 (free base), 358m5150ly
    Molecular Formula
    C19H30F3NO3
    Molecular Weight
    377.4  g/mol
    InChI Key
    JVCPIJKPAKAIIP-UHFFFAOYSA-N
    FDA UNII
    358M5150LY
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    2-amino-2-[2-[4-heptoxy-3-(trifluoromethyl)phenyl]ethyl]propane-1,3-diol
    2.1.2 InChI
    InChI=1S/C19H30F3NO3/c1-2-3-4-5-6-11-26-17-8-7-15(12-16(17)19(20,21)22)9-10-18(23,13-24)14-25/h7-8,12,24-25H,2-6,9-11,13-14,23H2,1H3
    2.1.3 InChI Key
    JVCPIJKPAKAIIP-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CCCCCCCOC1=C(C=C(C=C1)CCC(CO)(CO)N)C(F)(F)F
    2.2 Other Identifiers
    2.2.1 UNII
    358M5150LY
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. Mt-1303

    2.3.2 Depositor-Supplied Synonyms

    1. 942399-20-4

    2. Amiselimod [inn]

    3. Amiselimod Free Base

    4. Amiselimod(mt-1303) Free Base

    5. 942399-20-4 (free Base)

    6. 358m5150ly

    7. 2-amino-2-(4-(heptyloxy)-3-(trifluoromethyl)phenethyl)propane-1,3-diol

    8. 2-amino-2-(2-(4-heptyloxy-3-trifluoromethylphenyl)ethyl)propane-1,3-diol

    9. Amiselimod, Mt-1303

    10. 2-amino-2-[2-[4-heptoxy-3-(trifluoromethyl)phenyl]ethyl]propane-1,3-diol

    11. 2-amino-2-{2-[4-(heptyloxy)-3-(trifluoromethyl)phenyl]ethyl}propane-1,3-diol

    12. Unii-358m5150ly

    13. Amiselimod,mt1303

    14. Amiselimod (usan/inn)

    15. Amiselimod [usan]

    16. Amiselimod [who-dd]

    17. Mt-1303 Free Base

    18. Gtpl9319

    19. Schembl2463680

    20. Chembl3707375

    21. Dtxsid301141402

    22. Bcp24738

    23. Ex-a1427

    24. Mt1303

    25. Zinc43170189

    26. Akos032971355

    27. Example 1 [us20090137530]

    28. D10905

    29. Mt-1303; Mt1303; Mt 1303

    30. Q27256444

    31. 1,3-propanediol, 2-amino-2-(2-(4-(heptyloxy)-3-(trifluoromethyl)phenyl)ethyl)-

    32. 2-amino-2-[2-[4-(heptyloxy)-3-(trifluoromethyl)phenyl]ethyl]-1,3-propanediol

    2.4 Create Date
    2007-07-02
    3 Chemical and Physical Properties
    Molecular Weight 377.4 g/mol
    Molecular Formula C19H30F3NO3
    XLogP33.8
    Hydrogen Bond Donor Count3
    Hydrogen Bond Acceptor Count7
    Rotatable Bond Count12
    Exact Mass377.21777831 g/mol
    Monoisotopic Mass377.21777831 g/mol
    Topological Polar Surface Area75.7 Ų
    Heavy Atom Count26
    Formal Charge0
    Complexity376
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1