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    Octenidine Hydrochloride

    ACTIVE PHARMA INGREDIENTS

    INTERMEDIATES

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    $ API Ref.Price (USD/KG) : 1,049Xls

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    2D Structure
    Also known as: 70775-75-6, Octenidine hcl, Sensidin do, Win 41464-2, Octenidine hydrochloride [usan], U84956nu4b
    Molecular Formula
    C36H64Cl2N4
    Molecular Weight
    623.8  g/mol
    InChI Key
    SMGTYJPMKXNQFY-UHFFFAOYSA-N
    FDA UNII
    U84956NU4B
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    N-octyl-1-[10-(4-octyliminopyridin-1-yl)decyl]pyridin-4-imine;dihydrochloride
    2.1.2 InChI
    InChI=1S/C36H62N4.2ClH/c1-3-5-7-9-15-19-27-37-35-23-31-39(32-24-35)29-21-17-13-11-12-14-18-22-30-40-33-25-36(26-34-40)38-28-20-16-10-8-6-4-2;;/h23-26,31-34H,3-22,27-30H2,1-2H3;2*1H
    2.1.3 InChI Key
    SMGTYJPMKXNQFY-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CCCCCCCCN=C1C=CN(C=C1)CCCCCCCCCCN2C=CC(=NCCCCCCCC)C=C2.Cl.Cl
    2.2 Other Identifiers
    2.2.1 UNII
    U84956NU4B
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. Las-189962

    2. Las189962

    3. N,n'-(1,10-decanediyldi-1-(4h)-pyridinyl-4-ylidene)bis-(1-octamine) Dihydrochloride

    4. Octeniderm

    5. Octenidine

    6. Octenidine Dihydrochloride

    7. Octenidine Disaccharin

    8. Octenidine Hcl

    9. Octenidine Saccharin

    10. Octenidol

    11. Win 41,464-6

    12. Win 41464-2

    13. Win-41464-2

    14. Win-41464-6

    2.3.2 Depositor-Supplied Synonyms

    1. 70775-75-6

    2. Octenidine Hcl

    3. Sensidin Do

    4. Win 41464-2

    5. Octenidine Hydrochloride [usan]

    6. U84956nu4b

    7. Las189962

    8. Las-189962

    9. Win-41464-2

    10. 1,1'-(decane-1,10-diyl)bis(n-octylpyridin-4(1h)-imine) Dihydrochloride

    11. N-octyl-1-[10-(4-octyliminopyridin-1-yl)decyl]pyridin-4-imine;dihydrochloride

    12. Octenidine Hydrochloride (usan)

    13. 1,1'-decamethylenebis(1,4-dihydro-4-(octylimino)pyridine) Dihydrochloride

    14. 1-octanamine, N,n'-(1,10-decanediyldi-1(4h)-pyridinyl-4-ylidene)bis-, Dihydrochloride

    15. Chembl36342

    16. Octenidine Hcl [inci]

    17. Schembl126065

    18. Unii-u84956nu4b

    19. Hy-b2170a

    20. Dtxsid90221025

    21. Win-414642

    22. Bcp22785

    23. Einecs 274-861-8

    24. Mfcd01938808

    25. S5012

    26. Ccg-270262

    27. Cs-6224

    28. Octenidine Dihydrochloride [mi]

    29. Octenidine Hydrochloride [mart.]

    30. Octenidine Hydrochloride [who-dd]

    31. O0388

    32. D05222

    33. D86682

    34. A847887

    35. Q1409243

    36. B2692-013330

    37. N,n'-(1,10-decanediyldi-1(4h)-pyridinyl-4-ylidene)bis(1-octanamine) Dihydrochloride

    2.4 Create Date
    2005-08-08
    3 Chemical and Physical Properties
    Molecular Weight 623.8 g/mol
    Molecular Formula C36H64Cl2N4
    Hydrogen Bond Donor Count2
    Hydrogen Bond Acceptor Count4
    Rotatable Bond Count25
    Exact Mass622.4508034 g/mol
    Monoisotopic Mass622.4508034 g/mol
    Topological Polar Surface Area31.2 Ų
    Heavy Atom Count42
    Formal Charge0
    Complexity691
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count3
    4 Pharmacology and Biochemistry
    4.1 MeSH Pharmacological Classification

    Anti-Infective Agents

    Substances that prevent infectious agents or organisms from spreading or kill infectious agents in order to prevent the spread of infection. (See all compounds classified as Anti-Infective Agents.)

    Anti-Infective Agents, Local

    Substances used on humans and other animals that destroy harmful microorganisms or inhibit their activity. They are distinguished from DISINFECTANTS, which are used on inanimate objects. (See all compounds classified as Anti-Infective Agents, Local.)