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    Polyhexanide

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    2D Structure
    Also known as: Polyhexamethylene biguanide, 28757-47-3, Polyhexanide, 1-(diaminomethylidene)-2-hexylguanidine, Lavasept, Vantocil
    Molecular Formula
    C8H19N5
    Molecular Weight
    185.27  g/mol
    InChI Key
    VAZJLPXFVQHDFB-UHFFFAOYSA-N
    Polihexanide has been used in trials studying the treatment, prevention, and supportive care of Caries, Neoplasm, Skin Diseases, Nail Diseases, and Dental Plaque, among others.
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    1-(diaminomethylidene)-2-hexylguanidine
    2.1.2 InChI
    InChI=1S/C8H19N5/c1-2-3-4-5-6-12-8(11)13-7(9)10/h2-6H2,1H3,(H6,9,10,11,12,13)
    2.1.3 InChI Key
    VAZJLPXFVQHDFB-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CCCCCCN=C(N)N=C(N)N
    2.2 Synonyms
    2.2.1 MeSH Synonyms

    1. Baquacil

    2. Cosmocil

    3. Lavasept

    4. Phmb Polymer

    5. Polihexanide Hydrochloride

    6. Poly(hexamethylene Biguanide)

    7. Poly(hexamethylenebiguanide) Hydrochloride

    8. Poly(iminocarbonimidoyliminocarbonimidoylimino-1,6-hexanediyl) Hydrochloride

    9. Polyhexamethylen-biguanide

    10. Polyhexamethylenbiguanid

    11. Polyhexamethylenbiguanide

    12. Polyhexamethylene Biguanide

    13. Polyhexamethylene Biguanide Hydrochloride

    14. Polyhexanide

    15. Vantocil

    16. Vantocil Ib Of Vantocil

    2.2.2 Depositor-Supplied Synonyms

    1. Polyhexamethylene Biguanide

    2. 28757-47-3

    3. Polyhexanide

    4. 1-(diaminomethylidene)-2-hexylguanidine

    5. Lavasept

    6. Vantocil

    7. Polihexanide Hydrochloride

    8. Purista

    9. Microcare Mbg

    10. Cosmocil Cq

    11. N-hexylbiguanide

    12. 1-hexylbiguanide

    13. Schembl45011

    14. Chembl2106939

    15. Schembl20753163

    16. Dtxsid40873856

    17. N-hexylimidodicarbonimidic Diamide

    18. Zinc4217340

    19. Akos017531707

    20. Ft-0700841

    21. Q408205

    22. 24717-31-5

    2.3 Create Date
    2005-03-26
    3 Chemical and Physical Properties
    Molecular Weight 185.27 g/mol
    Molecular Formula C8H19N5
    XLogP30.5
    Hydrogen Bond Donor Count3
    Hydrogen Bond Acceptor Count1
    Rotatable Bond Count6
    Exact Mass185.16404563 g/mol
    Monoisotopic Mass185.16404563 g/mol
    Topological Polar Surface Area103 Ų
    Heavy Atom Count13
    Formal Charge0
    Complexity181
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
    4 Drug and Medication Information
    4.1 Drug Indication

    Treatment of Acanthamoeba keratitis

    5 Pharmacology and Biochemistry
    5.1 MeSH Pharmacological Classification

    Disinfectants

    Substances used on inanimate objects that destroy harmful microorganisms or inhibit their activity. Disinfectants are classed as complete, destroying SPORES as well as vegetative forms of microorganisms, or incomplete, destroying only vegetative forms of the organisms. They are distinguished from ANTISEPTICS, which are local anti-infective agents used on humans and other animals. (From Hawley's Condensed Chemical Dictionary, 11th ed) (See all compounds classified as Disinfectants.)

    5.2 ATC Code

    D - Dermatologicals

    D08 - Antiseptics and disinfectants

    D08A - Antiseptics and disinfectants

    D08AC - Biguanides and amidines

    D08AC05 - Polihexanide