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    Givinostat HCl

    ACTIVE PHARMA INGREDIENTS

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    2D Structure
    Also known as: 199657-29-9, Givinostat hcl, Givinostat (hydrochloride), Itf 2357, Z02132r2qq, Unii-z02132r2qq
    Molecular Formula
    C24H28ClN3O4
    Molecular Weight
    457.9  g/mol
    InChI Key
    QKSGNWJOQMSBEP-UHFFFAOYSA-N
    FDA UNII
    Z02132R2QQ
    Histone Deacetylase Inhibitor is any substance that inhibits histone deacetylase, an enzyme that catalyzes the removal of acetyl groups from core histones. Inhibition of histone deacetylase can result in hyperacetylation of histones, with an effect on gene expression and cell differentiation.
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    [6-(diethylaminomethyl)naphthalen-2-yl]methyl N-[4-(hydroxycarbamoyl)phenyl]carbamate;hydrochloride
    2.1.2 InChI
    InChI=1S/C24H27N3O4.ClH/c1-3-27(4-2)15-17-5-7-21-14-18(6-8-20(21)13-17)16-31-24(29)25-22-11-9-19(10-12-22)23(28)26-30;/h5-14,30H,3-4,15-16H2,1-2H3,(H,25,29)(H,26,28);1H
    2.1.3 InChI Key
    QKSGNWJOQMSBEP-UHFFFAOYSA-N
    2.2 Other Identifiers
    2.2.1 UNII
    Z02132R2QQ
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. Itf 2357

    2. Itf2357

    2.3.2 Depositor-Supplied Synonyms

    1. 199657-29-9

    2. Givinostat Hcl

    3. Givinostat (hydrochloride)

    4. Itf 2357

    5. Z02132r2qq

    6. Unii-z02132r2qq

    7. Itf2357 Hydrochloride

    8. Itf-2357 Hydrochloride

    9. Histone Deacetylase Inhibitor

    10. Itf2357

    11. Itf-2357

    12. Carbamic Acid, N-[4-[(hydroxyamino)carbonyl]phenyl]-, [6-[(diethylamino)methyl]-2-naphthalenyl]methyl Ester, Hydrochloride (1:1)

    13. [6-(diethylaminomethyl)naphthalen-2-yl]methyl N-[4-(hydroxycarbamoyl)phenyl]carbamate;hydrochloride

    14. Carbamic Acid, N-(4-((hydroxyamino)carbonyl)phenyl)-, (6-((diethylamino)methyl)-2-naphthalenyl)methyl Ester, Hydrochloride (1:1)

    15. (6-((diethylamino)methyl)naphthalen-2-yl)methyl (4-(hydroxycarbamoyl)phenyl)carbamate Hydrochloride

    16. Mfcd28502062

    17. {6-[(diethylamino)methyl]naphthalen-2-yl}methyl [4-(hydroxycarbamoyl)phenyl]carbamate Hydrochloride

    18. Itf 2357 Hydrochloride

    19. Givinostat Monohydrochloride

    20. Schembl23529420

    21. Givinostat Hydrochloride Anhydrous

    22. Chebi:231333

    23. Ex-a8024

    24. Zha65729

    25. Hy-14842a

    26. Akos030526700

    27. Cs-4728

    28. Sb16937

    29. As-52365

    30. En300-257964

    31. P14959

    32. Q27294820

    33. Z2327390266

    34. (6-((diethylamino)methyl)naphthalen-2-yl)methyl 4-(hydroxycarbamoyl)phenylcarbamate Hydrochloride

    35. [6-[(diethylamino)methyl]-2-naphthalenyl]methyl N-[4-[(hydroxyamino)carbonyl]phenyl]carbamate Hydrochloride (1:1)

    36. {6-[(diethylamino)methyl]naphthalen-2-yl}methyl [4-(hydroxycarbamoyl)phenyl]carbamate--hydrogen Chloride

    37. {6-[(diethylamino)methyl]naphthalen-2-yl}methyl N-[4-(hydroxycarbamoyl)phenyl]carbamate Hydrochloride

    2.3.3 Other Synonyms

    1. Givinostat

    2.4 Create Date
    2006-10-25
    3 Chemical and Physical Properties
    Molecular Weight 457.9 g/mol
    Molecular Formula C24H28ClN3O4
    Hydrogen Bond Donor Count4
    Hydrogen Bond Acceptor Count5
    Rotatable Bond Count9
    Exact Mass Da
    Monoisotopic Mass Da
    Topological Polar Surface Area90.9
    Heavy Atom Count32
    Formal Charge0
    Complexity575
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count2
    4 Pharmacology and Biochemistry
    4.1 MeSH Pharmacological Classification

    Histone Deacetylase Inhibitors

    Compounds that inhibit HISTONE DEACETYLASES. This class of drugs may influence gene expression by increasing the level of acetylated HISTONES in specific CHROMATIN domains. (See all compounds classified as Histone Deacetylase Inhibitors.)