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    Funapide

    DEVELOPMENTS

    DIGITAL CONTENT

    PharmaCompass
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    2D Structure
    Also known as: 1259933-16-8, Funapide, (+)-, Xen402, Xen-401-s, Tv-45070, A5595lhj2l
    Molecular Formula
    C22H14F3NO5
    Molecular Weight
    429.3  g/mol
    InChI Key
    NEBUOXBYNAHKFV-NRFANRHFSA-N
    FDA UNII
    A5595LHJ2L
    Funapide has been used in trials studying the treatment of Pharmacokinetics, Postherpetic Neuralgia, and Osteoarthritis of the Knee.
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    (7S)-1'-[[5-(trifluoromethyl)furan-2-yl]methyl]spiro[6H-furo[2,3-f][1,3]benzodioxole-7,3'-indole]-2'-one
    2.1.2 InChI
    InChI=1S/C22H14F3NO5/c23-22(24,25)19-6-5-12(31-19)9-26-15-4-2-1-3-13(15)21(20(26)27)10-28-16-8-18-17(7-14(16)21)29-11-30-18/h1-8H,9-11H2/t21-/m0/s1
    2.1.3 InChI Key
    NEBUOXBYNAHKFV-NRFANRHFSA-N
    2.1.4 Canonical SMILES
    C1C2(C3=CC=CC=C3N(C2=O)CC4=CC=C(O4)C(F)(F)F)C5=CC6=C(C=C5O1)OCO6
    2.1.5 Isomeric SMILES
    C1[C@]2(C3=CC=CC=C3N(C2=O)CC4=CC=C(O4)C(F)(F)F)C5=CC6=C(C=C5O1)OCO6
    2.2 Other Identifiers
    2.2.1 UNII
    A5595LHJ2L
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. Tv-45070

    2. Xen402

    2.3.2 Depositor-Supplied Synonyms

    1. 1259933-16-8

    2. Funapide, (+)-

    3. Xen402

    4. Xen-401-s

    5. Tv-45070

    6. A5595lhj2l

    7. (3's)-1'-[[5-(trifluoromethyl)-2-furanyl]methyl]spiro[furo[2,3-f]-1,3-benzodioxole-7(6h),3'-[3h]indol]-2'(1'h)-one

    8. Xen-402

    9. Xpf-002

    10. (7s)-1'-{[5-(trifluoromethyl)furan-2-yl]methyl}spiro[furo[2,3-f][1,3]benzodioxole-7,3'-indol]-2'(1'h)-one

    11. Spiro[furo[2,3-f]-1,3-benzodioxole-7(6h),3'-[3h]indol]-2'(1'h)-one, 1'-[[5-(trifluoromethyl)-2-furanyl]methyl]-, (3's)-

    12. (3's)-1'-((5-(trifluoromethyl)furan-2-yl)methyl)-2h,6h-spiro(furo(2,3-f)(1,3)benzodioxole-7,3'-indol)-2'(1'h)-one

    13. Spiro(furo(2,3-f)-1,3-benzodioxole-7(6h),3'-(3h)indol)-2'(1'h)-one, 1'-((5-(trifluoromethyl)-2-furanyl)methyl)-, (3's)-

    14. Funapide [inn]

    15. (3's)-1'-{[5-(trifluoromethyl)furan-2-yl]methyl}-2h,6h-spiro[furo[2,3-f][1,3]benzodioxole-7,3'-indol]-2'(1'h)-one

    16. Funapide [usan:inn]

    17. Unii-a5595lhj2l

    18. Funapide; Xen402

    19. Funapide [usan]

    20. Funapide (usan/inn)

    21. Funapide [who-dd]

    22. Schembl1612849

    23. Chembl3707218

    24. Bdbm206760

    25. Ex-a2684

    26. Mfcd28502435

    27. Akos030228679

    28. Zinc113473392

    29. Db11769

    30. Sb18915

    31. Hy-16723

    32. Us9260446, (i-s)

    33. Cs-0012323

    34. J3.591.370j

    35. D11156

    36. Q18393205

    37. (3s)-1-[[5-(trifluoromethyl)-2-furanyl]methyl]spiro[furo[2,3-f]-1,3-benzodioxole-7(6h),3-[3h]indol]-2(1h)-one

    38. (3s)-1-[5-(trifluoromethyl)-2-furanylmethyl]spiro[indoline-3,7'(6'h)-furo[2,3-f]-1,3-benzodioxole]-2-one

    39. (7s)-1'-[[5-(trifluoromethyl)furan-2-yl]methyl]spiro[6h-furo[2,3-f][1,3]benzodioxole-7,3'-indole]-2'-one

    40. (7s)-1'-{[5-(trifluoromethyl)furan-2-yl]methyl}spiro-[furo[2,3-f][1,3]benzodioxole-7,3'-indol]-2'(1'h)-one

    41. (s)-1'-((5-(trifluoromethyl)furan-2-yl)methyl)-6h-spiro[[1,3]dioxolo[4,5-f]benzofuran-7,3'-indolin]-2'-one

    2.4 Create Date
    2011-01-17
    3 Chemical and Physical Properties
    Molecular Weight 429.3 g/mol
    Molecular Formula C22H14F3NO5
    XLogP33.5
    Hydrogen Bond Donor Count0
    Hydrogen Bond Acceptor Count8
    Rotatable Bond Count2
    Exact Mass429.08240703 g/mol
    Monoisotopic Mass429.08240703 g/mol
    Topological Polar Surface Area61.1 Ų
    Heavy Atom Count31
    Formal Charge0
    Complexity734
    Isotope Atom Count0
    Defined Atom Stereocenter Count1
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1