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    Oxomemazine Hydrochloride

    ACTIVE PHARMA INGREDIENTS

    PharmaCompass
    $ API Ref.Price (USD/KG) : 290Xls

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    2D Structure
    Also known as: 4784-40-1, N,n,beta-trimethyl-10h-phenothiazine-10-propylamine 5,5-dioxide monohydrochloride, 6bok44g9k6, 3-(5,5-dioxophenothiazin-10-yl)-n,n,2-trimethylpropan-1-amine;hydrochloride, N,n,beta-trimethyl-10h-phenothiazine-10-propylamine5,5-dioxidemonohydrochloride, Einecs 225-330-4
    Molecular Formula
    C18H23ClN2O2S
    Molecular Weight
    366.9  g/mol
    InChI Key
    NPMMOYKGIWLASW-UHFFFAOYSA-N
    FDA UNII
    6BOK44G9K6
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    3-(5,5-dioxophenothiazin-10-yl)-N,N,2-trimethylpropan-1-amine;hydrochloride
    2.1.2 InChI
    InChI=1S/C18H22N2O2S.ClH/c1-14(12-19(2)3)13-20-15-8-4-6-10-17(15)23(21,22)18-11-7-5-9-16(18)20;/h4-11,14H,12-13H2,1-3H3;1H
    2.1.3 InChI Key
    NPMMOYKGIWLASW-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CC(CN1C2=CC=CC=C2S(=O)(=O)C3=CC=CC=C31)CN(C)C.Cl
    2.2 Other Identifiers
    2.2.1 UNII
    6BOK44G9K6
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. 4784-40-1

    2. N,n,beta-trimethyl-10h-phenothiazine-10-propylamine 5,5-dioxide Monohydrochloride

    3. 6bok44g9k6

    4. 3-(5,5-dioxophenothiazin-10-yl)-n,n,2-trimethylpropan-1-amine;hydrochloride

    5. N,n,beta-trimethyl-10h-phenothiazine-10-propylamine5,5-dioxidemonohydrochloride

    6. Einecs 225-330-4

    7. Ncgc00182075-03

    8. Unii-6bok44g9k6

    9. Oxomemazine Hcl

    10. Dsstox_cid_28538

    11. Dsstox_rid_82810

    12. Dsstox_gsid_48612

    13. Schembl4420096

    14. Chembl3187201

    15. Dtxsid2048612

    16. Tox21_112947

    17. Oxomemazine Hydrochloride [who-dd]

    18. Cas-4784-40-1

    19. Q27264452

    20. 10h-phenothiazine-10-propanamine, N,n,.beta.-trimethyl-, 5,5-dioxide, Hydrochloride (1:1)

    21. 10h-phenothiazine-10-propanamine, N,n,.beta.-trimethyl-, 5,5-dioxide, Monohydrochloride

    22. 13718-11-1

    23. Phenothiazine, 10-(3-(dimethylamino)-2-methylpropyl)-, 5,5-dioxide, Monohydrochloride

    2.4 Create Date
    2005-08-09
    3 Chemical and Physical Properties
    Molecular Weight 366.9 g/mol
    Molecular Formula C18H23ClN2O2S
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count4
    Rotatable Bond Count4
    Exact Mass366.1168768 g/mol
    Monoisotopic Mass366.1168768 g/mol
    Topological Polar Surface Area49 Ų
    Heavy Atom Count24
    Formal Charge0
    Complexity470
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count1
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count2