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    Etifoxine

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    2D Structure
    Also known as: 56776-32-0, Etifoxine hcl, Etifoxine (hydrochloride), Stresam, 6-chloro-n-ethyl-4-methyl-4-phenyl-4h-3,1-benzoxazin-2-amine monohydrochloride, Nbl8010wh5
    Molecular Formula
    C17H18Cl2N2O
    Molecular Weight
    337.2  g/mol
    InChI Key
    SCBJXEBIMVRTJE-UHFFFAOYSA-N
    FDA UNII
    NBL8010WH5
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    6-chloro-N-ethyl-4-methyl-4-phenyl-1H-3,1-benzoxazin-2-imine;hydrochloride
    2.1.2 InChI
    InChI=1S/C17H17ClN2O.ClH/c1-3-19-16-20-15-10-9-13(18)11-14(15)17(2,21-16)12-7-5-4-6-8-12;/h4-11H,3H2,1-2H3,(H,19,20);1H
    2.1.3 InChI Key
    SCBJXEBIMVRTJE-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CCN=C1NC2=C(C=C(C=C2)Cl)C(O1)(C)C3=CC=CC=C3.Cl
    2.2 Other Identifiers
    2.2.1 UNII
    NBL8010WH5
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. 2-ethylamino-6-chloro-4-methyl-4-phenyl-4h-3,1-benzoxazine

    2. Etafenoxine

    3. Etafenoxine Hydrochloride

    4. Etifoxin

    5. Etifoxine

    6. Hoe 36801

    7. Stresam

    2.3.2 Depositor-Supplied Synonyms

    1. 56776-32-0

    2. Etifoxine Hcl

    3. Etifoxine (hydrochloride)

    4. Stresam

    5. 6-chloro-n-ethyl-4-methyl-4-phenyl-4h-3,1-benzoxazin-2-amine Monohydrochloride

    6. Nbl8010wh5

    7. Hoe 36-801 (hydrochloride)

    8. Etifoxin

    9. 6-chloro-2-n-ethyl-4-methyl-4-phenyl-4h-3,1-benzoxazin-2-amine Hydrochloride

    10. 6-chloro-n-ethyl-4-methyl-4-phenyl-3,1-benzoxazin-2-amine;hydrochloride

    11. Unii-nbl8010wh5

    12. Einecs 260-380-0

    13. Stresam (tn)

    14. Hoe-36801 Hydrochloride

    15. Mls006010668

    16. Schembl547700

    17. Dtxsid50972228

    18. Hoe-36-801

    19. Bcp20603

    20. Etifoxine Hydrochloride [mi]

    21. 6-chloro-n-ethyl-4-methyl-4-phenyl-3,1-benzoxazin-2-amine Hydrochloride

    22. Akos024457433

    23. Cs-1103

    24. Etifoxine Hydrochloride [mart.]

    25. Etifoxine Hydrochloride [who-dd]

    26. Bs-17088

    27. Etifoxine Hydrochloride, >=98% (hplc)

    28. Hy-16579

    29. Smr002529561

    30. Ft-0668419

    31. D07930

    32. Hoe 36-801 Hydrochloridehoe 36-801 Hydrochloride

    33. Q27284779

    34. 6-chloro-n-ethyl-4-methyl-4-phenyl-4h-3,1-benzoxazin-2-amine Hcl

    35. 4h-3,1-benzoxazin-2-amine, 6-chloro-n-ethyl-4-methyl-4-phenyl-, Monohydrochloride

    36. 6-chloro-n-ethyl-4-methyl-4-phenyl-1h-3,1-benzoxazin-2-imine;hydrochloride

    37. 6-chloro-n-ethyl-4-methyl-4-phenyl-1,4-dihydro-2h-3,1-benzoxazin-2-imine--hydrogen Chloride (1/1)

    2.4 Create Date
    2019-01-15
    3 Chemical and Physical Properties
    Molecular Weight 337.2 g/mol
    Molecular Formula C17H18Cl2N2O
    Hydrogen Bond Donor Count2
    Hydrogen Bond Acceptor Count2
    Rotatable Bond Count2
    Exact Mass336.0796186 g/mol
    Monoisotopic Mass336.0796186 g/mol
    Topological Polar Surface Area33.6 Ų
    Heavy Atom Count22
    Formal Charge0
    Complexity394
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count1
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count2
    4 Pharmacology and Biochemistry
    4.1 MeSH Pharmacological Classification

    Anti-Anxiety Agents

    Agents that alleviate ANXIETY, tension, and ANXIETY DISORDERS, promote sedation, and have a calming effect without affecting clarity of consciousness or neurologic conditions. ADRENERGIC BETA-ANTAGONISTS are commonly used in the symptomatic treatment of anxiety but are not included here. (See all compounds classified as Anti-Anxiety Agents.)