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    Clonixin Lysine

    ACTIVE PHARMA INGREDIENTS

    MARKET PLACE

    PharmaCompass
    $ API Ref.Price (USD/KG) : 207Xls

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    2D Structure
    Also known as: Clonixin lysine salt, 55837-30-4, L-lysine clonixinate, Clonixin lysine, L 104, L-104
    Molecular Formula
    C19H25ClN4O4
    Molecular Weight
    408.9  g/mol
    InChI Key
    CVNFYQCHAWFYQI-ZSCHJXSPSA-N
    FDA UNII
    06PW4M190R
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    2-(3-chloro-2-methylanilino)pyridine-3-carboxylic acid;(2S)-2,6-diaminohexanoic acid
    2.1.2 InChI
    InChI=1S/C13H11ClN2O2.C6H14N2O2/c1-8-10(14)5-2-6-11(8)16-12-9(13(17)18)4-3-7-15-12;7-4-2-1-3-5(8)6(9)10/h2-7H,1H3,(H,15,16)(H,17,18);5H,1-4,7-8H2,(H,9,10)/t;5-/m.0/s1
    2.1.3 InChI Key
    CVNFYQCHAWFYQI-ZSCHJXSPSA-N
    2.1.4 Canonical SMILES
    CC1=C(C=CC=C1Cl)NC2=C(C=CC=N2)C(=O)O.C(CCN)CC(C(=O)O)N
    2.1.5 Isomeric SMILES
    CC1=C(C=CC=C1Cl)NC2=C(C=CC=N2)C(=O)O.C(CCN)C[C@@H](C(=O)O)N
    2.2 Other Identifiers
    2.2.1 UNII
    06PW4M190R
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. L 104

    2. L-104

    2.3.2 Depositor-Supplied Synonyms

    1. Clonixin Lysine Salt

    2. 55837-30-4

    3. L-lysine Clonixinate

    4. Clonixin Lysine

    5. L 104

    6. L-104

    7. 2-(2'-methyl-3'-chloroanilino)lysine Nicotinate

    8. L-lysine, 2-[(3-chloro-2-methylphenyl)amino]-3-pyridinecarboxylate (1:1)

    9. Clonixin Lysinate

    10. 06pw4m190r

    11. L-lysine, Mono(2-((3-chloro-2-methylphenyl)amino)-3-pyridinecarboxylate)

    12. Dolalgial

    13. Mfcd07364029

    14. 2-(3-chloro-2-methylanilino)pyridine-3-carboxylic Acid;(2s)-2,6-diaminohexanoic Acid

    15. 2-[(3-chloro-2-methylphenyl)amino]pyridine-3-carboxylic Acid (2s)-2,6-diaminohexanoic Acid

    16. L-lysine Compound With 2-((3-chloro-2-methylphenyl)amino)nicotinic Acid (1:1)

    17. Unii-06pw4m190r

    18. Clonixin-lysinate

    19. L-lysine, 2-((3-chloro-2-methylphenyl)amino)-3-pyridinecarboxylate (1:1)

    20. Clonixil (tn)

    21. L-clonixin Lysine Salt

    22. Chembl4303711

    23. Clonixin Lysine [mart.]

    24. Chebi:76201

    25. Dtxsid10204436

    26. Clonixin Lysine Salt [mi]

    27. Hms2098m10

    28. Hms3715m10

    29. L-lysine Clonixinate Hydrochloride

    30. Clonixin Lysinate [who-dd]

    31. L-lysine 2-[(3-chloro-2-methylphenyl)amino]-3-pyridinecarboxylate

    32. Akos015895798

    33. Ac-1606

    34. Ccg-221104

    35. 3-pyridinecarboxylic Acid, 2-((3-chloro-2-methylphenyl)amino)-, Compd. With L-lysine (1:1)

    36. As-73002

    37. Lysine Clonixinate (l-lysine Clonixinate)

    38. R-173

    39. D07728

    40. D97791

    41. 837l304

    42. Sr-01000872701

    43. Sr-01000872701-1

    44. Q27145806

    45. 2-(3-chloro-o-toluidino)nicotinic Acid, Lysine Salt

    46. 2-[(3-chloro-2-methylphenyl)amino]nicotinic Acid--l-lysine (1/1)

    47. (2s)-2,6-diazaniumylhexanoate 2-[(3-chloro-2-methylphenyl)amino]nicotinate

    48. L-lysinemono (2-((3-chloro-2-methylphenyl)amino)-3-pyridinecarboxylate)

    49. [(5s)-5-amino-5-carboxypentyl]azanium;2-(3-chloro-2-methylanilino)pyridine-3-carboxylate

    50. (2s)-2,6-diaminohexanoic Acid; 2-[(3-chloro-2-methylphenyl)amino]pyridine-3-carboxylic Acid

    2.4 Create Date
    2005-08-09
    3 Chemical and Physical Properties
    Molecular Weight 408.9 g/mol
    Molecular Formula C19H25ClN4O4
    Hydrogen Bond Donor Count5
    Hydrogen Bond Acceptor Count8
    Rotatable Bond Count8
    Exact Mass408.1564330 g/mol
    Monoisotopic Mass408.1564330 g/mol
    Topological Polar Surface Area152 Ų
    Heavy Atom Count28
    Formal Charge0
    Complexity407
    Isotope Atom Count0
    Defined Atom Stereocenter Count1
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count2