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    Chemistry

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    Also known as: Toltrazuril sulfone, 69004-04-2, Toltrazuril (sulfone), 1-methyl-3-{3-methyl-4-[4-(trifluoromethylsulfonyl)phenoxy]phenyl}-1,3,5-triazine-2,4,6(1h,3h,5h)-trione, Ponazuril [inn], 1-methyl-3-[3-methyl-4-[4-(trifluoromethylsulfonyl)phenoxy]phenyl]-1,3,5-triazinane-2,4,6-trione
    Molecular Formula
    C18H14F3N3O6S
    Molecular Weight
    457.4  g/mol
    InChI Key
    VBUNOIXRZNJNAD-UHFFFAOYSA-N
    FDA UNII
    JPW84AS66U
    Ponazuril
    Ponazuril, sold by the Bayer Corporation under the trade name Marquis, is a drug currently approved for the treatment of equine protozoal myeloencephalitis in horses, caused by Sarcocystis neurona.
    1 2D Structure

    Ponazuril

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    1-methyl-3-[3-methyl-4-[4-(trifluoromethylsulfonyl)phenoxy]phenyl]-1,3,5-triazinane-2,4,6-trione
    2.1.2 InChI
    InChI=1S/C18H14F3N3O6S/c1-10-9-11(24-16(26)22-15(25)23(2)17(24)27)3-8-14(10)30-12-4-6-13(7-5-12)31(28,29)18(19,20)21/h3-9H,1-2H3,(H,22,25,26)
    2.1.3 InChI Key
    VBUNOIXRZNJNAD-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CC1=C(C=CC(=C1)N2C(=O)NC(=O)N(C2=O)C)OC3=CC=C(C=C3)S(=O)(=O)C(F)(F)F
    2.2 Other Identifiers
    2.2.1 UNII
    JPW84AS66U
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. Toltrazuril Sulfone

    2. 69004-04-2

    3. Toltrazuril (sulfone)

    4. 1-methyl-3-{3-methyl-4-[4-(trifluoromethylsulfonyl)phenoxy]phenyl}-1,3,5-triazine-2,4,6(1h,3h,5h)-trione

    5. Ponazuril [inn]

    6. 1-methyl-3-[3-methyl-4-[4-(trifluoromethylsulfonyl)phenoxy]phenyl]-1,3,5-triazinane-2,4,6-trione

    7. Jpw84as66u

    8. Ncgc00182044-01

    9. 1-methyl-3-(4-(p-((trifluoromethyl)sulfonyl)phenoxy)-m-tolyl)-s-triazine-2,4,6(1h,3h,5h)-trione.

    10. Marquis

    11. 1-methyl-3-(4-(p-((trifluoromethyl)sulfonyl)phenoxy)-m-tolyl)-s-triazine-2,4,6(1h,3h,5h)-trione

    12. Unii-jpw84as66u

    13. Bay-vi 9143

    14. Marquis (vet Use Only)

    15. Ponazuril [mi]

    16. Dsstox_cid_28884

    17. Dsstox_rid_83152

    18. Dsstox_gsid_48958

    19. Schembl203030

    20. Ponazuril [green Book]

    21. Acd855

    22. Chembl2104856

    23. Dtxsid7048958

    24. Gtpl12223

    25. Acd-855

    26. Bcp14930

    27. Tox21_113390

    28. Zinc33854754

    29. Ponazuril 100 Microg/ml In Methanol

    30. Akos025312522

    31. Cs-0615

    32. Db11452

    33. Ncgc00182044-02

    34. Ac-28364

    35. As-74844

    36. Hy-17008

    37. Cas-69004-04-2

    38. Ft-0673975

    39. D95987

    40. 774p233

    41. A836307

    42. Q7227567

    43. Toltrazuril Sulfone, Vetranal(tm), Analytical Standard

    44. 1-methyl-3-[3-methyl-4-(4-trifluoromethanesulfonylphenoxy)phenyl]-1,3,5-triazinane-2,4,6-trione

    45. 1-methyl-3-[3-methyl-4-[4-(trifluoromethylsulfonyl)phenoxy]phenyl]-1,3,5-triazinane-2,4,6-trione;toltrazuril Sulfone

    2.4 Create Date
    2005-08-09
    3 Chemical and Physical Properties
    Molecular Weight 457.4 g/mol
    Molecular Formula C18H14F3N3O6S
    XLogP33.1
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count9
    Rotatable Bond Count4
    Exact Mass457.05554083 g/mol
    Monoisotopic Mass457.05554083 g/mol
    Topological Polar Surface Area122 Ų
    Heavy Atom Count31
    Formal Charge0
    Complexity836
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1

    API Reference Price

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Import","activeIngredients":"","year":"2021","qtr":"Q2","strtotime":1619721000,"product":"PONAZURIL","address":"3RD FLOOR, NO.301, DOSTI PINNACLE","city":"ESTATE,DIST.THANE WEST, M.S.","supplier":"LGM PHARMA","supplierCountry":"UNITED STATES","foreign_port":"N\/A","customer":"ALIVIRA ANIMAL HEALTH","customerCountry":"INDIA","quantity":"60.00","actualQuantity":"60","unit":"KGS","unitRateFc":"650","totalValueFC":"39891","currency":"USD","unitRateINR":"49497.5","date":"30-Apr-2021","totalValueINR":"2969850","totalValueInUsd":"39891","indian_port":"Vizag-RPCIPL SEZ","hs_no":"29335990","bill_no":"1000624","productDescription":"API","marketType":"REGULATED MARKET","country":"UNITED STATES","selfForZScoreResived":"Pharma Grade","supplierPort":"N\/A","supplierAddress":"N\/A","customerAddress":"3RD FLOOR, NO.301, DOSTI PINNACLE"}]
    30-Apr-2021
    24-Dec-2023
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