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    Morclofone

    INTERMEDIATES

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    PharmaCompass
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    2D Structure
    Also known as: 31848-01-8, Morclofone [inn], Plausitin, 4'-chloro-3,5-dimethoxy-4-(2-morpholinoethoxy)benzophenone, Dimeclophenone, Vy62tib872
    Molecular Formula
    C21H24ClNO5
    Molecular Weight
    405.9  g/mol
    InChI Key
    KVCJCEKJKGLBOK-UHFFFAOYSA-N
    FDA UNII
    VY62TIB872
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    (4-chlorophenyl)-[3,5-dimethoxy-4-(2-morpholin-4-ylethoxy)phenyl]methanone
    2.1.2 InChI
    InChI=1S/C21H24ClNO5/c1-25-18-13-16(20(24)15-3-5-17(22)6-4-15)14-19(26-2)21(18)28-12-9-23-7-10-27-11-8-23/h3-6,13-14H,7-12H2,1-2H3
    2.1.3 InChI Key
    KVCJCEKJKGLBOK-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    COC1=CC(=CC(=C1OCCN2CCOCC2)OC)C(=O)C3=CC=C(C=C3)Cl
    2.2 Other Identifiers
    2.2.1 UNII
    VY62TIB872
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. Morclofone Hydrochloride

    2. Morclophone

    2.3.2 Depositor-Supplied Synonyms

    1. 31848-01-8

    2. Morclofone [inn]

    3. Plausitin

    4. 4'-chloro-3,5-dimethoxy-4-(2-morpholinoethoxy)benzophenone

    5. Dimeclophenone

    6. Vy62tib872

    7. Morclofone (inn)

    8. K 3712; Medicil; Nitux; Plausitin

    9. Morclofona

    10. Morclofonum

    11. Morclofonum [inn-latin]

    12. Morclofona [inn-spanish]

    13. Einecs 250-838-8

    14. Brn 1050359

    15. Unii-vy62tib872

    16. Morclofon

    17. K 3712

    18. Plausitin (tn)

    19. Morclofone [mi]

    20. Benzophenone, 4'-chloro-3,5-dimethoxy-4-(2-morpholinoethoxy)-

    21. Methanone, (4-chlorophenyl)(3,5-dimethoxy-4-(2-(4-morpholinyl)ethoxy)phenyl)-

    22. Morclofone [mart.]

    23. Morclofone [who-dd]

    24. Schembl554800

    25. Chembl2105158

    26. Dtxsid50185710

    27. Chebi:135657

    28. 3-chloro-5-methoxyphenylboronic?acid

    29. Zinc30691542

    30. (4-chlorophenyl)-[3,5-dimethoxy-4-(2-morpholin-4-ylethoxy)phenyl]methanone

    31. Db13558

    32. D07395

    33. Q6909555

    2.4 Create Date
    2005-08-08
    3 Chemical and Physical Properties
    Molecular Weight 405.9 g/mol
    Molecular Formula C21H24ClNO5
    XLogP33.5
    Hydrogen Bond Donor Count0
    Hydrogen Bond Acceptor Count6
    Rotatable Bond Count8
    Exact Mass405.1343006 g/mol
    Monoisotopic Mass405.1343006 g/mol
    Topological Polar Surface Area57.2 Ų
    Heavy Atom Count28
    Formal Charge0
    Complexity465
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
    4 Pharmacology and Biochemistry
    4.1 ATC Code

    R - Respiratory system

    R05 - Cough and cold preparations

    R05D - Cough suppressants, excl. combinations with expectorants

    R05DB - Other cough suppressants

    R05DB25 - Morclofone