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    Amodiaquin Dihydrochloride Dihydrate

    ACTIVE PHARMA INGREDIENTS

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    2D Structure
    Also known as: 6398-98-7, Amodiaquine hcl, Amodiaquine hydrochloride, Amodiaquine dihydrochloride dihydrate, 4-((7-chloroquinolin-4-yl)amino)-2-((diethylamino)methyl)phenol dihydrochloride dihydrate, Amodiaquin hcl hydrate
    Molecular Formula
    C20H28Cl3N3O3
    Molecular Weight
    464.8  g/mol
    InChI Key
    YVNAYSHNIILOJS-UHFFFAOYSA-N
    FDA UNII
    K6PW2S574L
    A 4-aminoquinoline compound with anti-inflammatory properties.
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    4-[(7-chloroquinolin-4-yl)amino]-2-(diethylaminomethyl)phenol;dihydrate;dihydrochloride
    2.1.2 InChI
    InChI=1S/C20H22ClN3O.2ClH.2H2O/c1-3-24(4-2)13-14-11-16(6-8-20(14)25)23-18-9-10-22-19-12-15(21)5-7-17(18)19;;;;/h5-12,25H,3-4,13H2,1-2H3,(H,22,23);2*1H;2*1H2
    2.1.3 InChI Key
    YVNAYSHNIILOJS-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CCN(CC)CC1=C(C=CC(=C1)NC2=C3C=CC(=CC3=NC=C2)Cl)O.O.O.Cl.Cl
    2.2 Other Identifiers
    2.2.1 UNII
    K6PW2S574L
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. Amodiachin

    2. Amodiaquin

    3. Amodiaquine

    4. Amodiaquine Hydrochloride

    5. Camoquin

    6. Camoquine

    7. Flavoquine

    8. Hydrochloride, Amodiaquine

    2.3.2 Depositor-Supplied Synonyms

    1. 6398-98-7

    2. Amodiaquine Hcl

    3. Amodiaquine Hydrochloride

    4. Amodiaquine Dihydrochloride Dihydrate

    5. 4-((7-chloroquinolin-4-yl)amino)-2-((diethylamino)methyl)phenol Dihydrochloride Dihydrate

    6. Amodiaquin Hcl Hydrate

    7. K6pw2s574l

    8. Amodiaquine Hydrochloride [usp]

    9. 6398-98-7 (hcl Hydrate)

    10. Amodiaquine (dihydrochloride Dihydrate)

    11. Nsc-755863

    12. Ncgc00017063-01

    13. Cas-6398-98-7

    14. 4-[(7-chloroquinolin-4-yl)amino]-2-(diethylaminomethyl)phenol Dihydrate Dihydrochloride

    15. 4-[(7-chloroquinolin-4-yl)amino]-2-(diethylaminomethyl)phenol;dihydrate;dihydrochloride

    16. Amodiaquine Hydrochloride (usp)

    17. Camoquin Hydrochloride

    18. Chebi:50652

    19. Phenol, 4-((7-chloro-4-quinolinyl)amino)-2-((diethylamino)methyl)-, Dihydrochloride, Dihydrate

    20. Cam-aq 1

    21. Unii-k6pw2s574l

    22. Amodiaquin Dihydrochlorid-2-wasser

    23. Prestwick_677

    24. Sn 10751

    25. Amodiaquini Hydrochloridum

    26. Amodiaquin Dihcl Dihydrate

    27. Camoquin Hydrochloride (tn)

    28. Dsstox_cid_25568

    29. Dsstox_rid_80965

    30. Dsstox_gsid_45568

    31. Amodiaquindihydrochloridedihydrate

    32. Chembl1357648

    33. Dtxsid3045568

    34. S4589 Amodiaquin (dihydrochlori

    35. Hms1568n20

    36. Hy-b1322

    37. Tox21_110765

    38. Mfcd09260307

    39. S4589

    40. Akos016339633

    41. Ccg-220309

    42. Cs-4895

    43. Ks-1326

    44. Ks-5250

    45. Nsc 755863

    46. 4-((7-chloro-4-quinolyl)amino)-alpha-(diethylamino)-o-cresol Dihydrochloride Dihydrate

    47. 4-(7-chloro-4-quinolinylamino)-2-(diethylaminomethyl)phenol Dihydrochloride Dihydrate

    48. Amodiaquine Hydrochloride [mart.]

    49. Amodiaquine Hydrochloride [vandf]

    50. Ncgc00017063-02

    51. Ncgc00017063-03

    52. Amodiaquine Hydrochloride [usp-rs]

    53. Amodiaquine Hydrochloride [who-dd]

    54. Amodiaquine Hydrochloride [who-ip]

    55. Db-054591

    56. Ft-0740309

    57. A16405

    58. Amodiaquine Hydrochloride [orange Book]

    59. D02466

    60. D95328

    61. Amodiaquine Hydrochloride [usp Monograph]

    62. Amodiaquini Hydrochloridum [who-ip Latin]

    63. A834604

    64. Amodiaquine Dihydrochloride Dihydrate [mi]

    65. Amodiaquine Hydrochloride Dihydrate [who-dd]

    66. Q27122169

    67. Z1563146060

    68. 4-[(7-chloranylquinolin-4-yl)amino]-2-(diethylaminomethyl)phenol Dihydrate Dihydrochloride

    69. 4-[(7-chloro-4-quinolinyl)amino]-2-(diethylaminomethyl)phenol Dihydrate Dihydrochloride

    70. O-cresol, 4-((7-chloro-4-quinolyl)amino)-alpha-(diethylamino)-, Dihydrochloride, Dihydrate

    71. 4-((7-chloro-4-quinolyl)amino)-.alpha.-(diethylamino)-o-cresol Dihydrochloride Dihydrate

    2.4 Create Date
    2005-08-08
    3 Chemical and Physical Properties
    Molecular Weight 464.8 g/mol
    Molecular Formula C20H28Cl3N3O3
    Hydrogen Bond Donor Count6
    Hydrogen Bond Acceptor Count6
    Rotatable Bond Count6
    Exact Mass463.119625 g/mol
    Monoisotopic Mass463.119625 g/mol
    Topological Polar Surface Area50.4 Ų
    Heavy Atom Count29
    Formal Charge0
    Complexity406
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count5
    4 Pharmacology and Biochemistry
    4.1 MeSH Pharmacological Classification

    Antimalarials

    Agents used in the treatment of malaria. They are usually classified on the basis of their action against plasmodia at different stages in their life cycle in the human. (From AMA, Drug Evaluations Annual, 1992, p1585) (See all compounds classified as Antimalarials.)