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    Technical details about Dicycloplatin, learn more about the structure, uses, toxicity, action, side effects and more

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    Dicycloplatin

    APIs // Active Pharmaceutical Ingredients

    INTERMEDIATES

    PharmaCompass

    Inke S.A: APIs manufacturing plant.

    ChemWerth works in generic API development & supply, non-infringement patent strategy development and regulatory support.

    2D Structure
    1. Also known as: 0kc57i4unb, Azane, 1-carboxycyclobutane-1-carboxylate, platinum(2+), 287402-09-9, Platinum(2+) 1-carboxycyclobutanecarboxylate ammoniate (1:2:2), Unii-0kc57i4unb, Dicycloplatin [who-dd]
    Molecular Formula
    C12H20N2O8Pt
    Molecular Weight
    515.38  g/mol
    InChI Key
    IIJQICKYWPGJDT-UHFFFAOYSA-L
    FDA UNII
    0KC57I4UNB
    Dicycloplatin is a third-generation, supramolecular platinum-based compound composed of carboplatin linked, by a strong hydrogen bond, to 1,1-cyclobutane dicarboxylate (CBDCA), with potential antineoplastic activity. Although the exact mechanism of action has yet to be fully elucidated, dicycloplatin appears to have a mechanism of action similar to that of other platinum-based compounds, which involves both DNA binding and the formation of DNA crosslinks. This mechanism results in the induction of apoptosis and cell growth inhibition. Compared to carboplatin alone, dicycloplatin shows enhanced solubility and stability in aqueous solution and appears to have a more favorable toxicity profile.
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    azane;cyclobutane-1,1-dicarboxylate;cyclobutane-1,1-dicarboxylic acid;platinum(2+)
    2.1.2 InChI
    InChI=1S/2C6H8O4.2H3N.Pt/c2*7-4(8)6(5(9)10)2-1-3-6;;;/h2*1-3H2,(H,7,8)(H,9,10);2*1H3;/q;;;;+2/p-2
    2.1.3 InChI Key
    IIJQICKYWPGJDT-UHFFFAOYSA-L
    2.1.4 Canonical SMILES
    C1CC(C1)(C(=O)O)C(=O)O.C1CC(C1)(C(=O)[O-])C(=O)[O-].N.N.[Pt+2]
    2.2 Other Identifiers
    2.2.1 UNII
    0KC57I4UNB
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. Cis-diammine(1,1-cyclobutanedicarboxylate)platinum(ii)

    2. Diammine(1,1-cyclobutanedicarboxylate)platinum(ii)

    2.3.2 Depositor-Supplied Synonyms

    1. 0kc57i4unb

    2. Azane, 1-carboxycyclobutane-1-carboxylate, Platinum(2+)

    3. 287402-09-9

    4. Platinum(2+) 1-carboxycyclobutanecarboxylate Ammoniate (1:2:2)

    5. Unii-0kc57i4unb

    6. Dicycloplatin [who-dd]

    7. 1,1-cyclobutanedicarboxylic Acid, Compd. With (sp-4-2)-diammine(1,1-cyclobutanedi(carboxylato-kappao)(2-))platinum (1:1)

    8. Platinum, Diammine(1,1-cyclobutanedi(carboxylato-kappao)(2-))-, (sp-4-2)-, 1,1-cyclobutanedicarboxylate (1:1)

    9. Platinum, Diammine(1,1-cyclobutanedicarboxylato(2-)-kappao,kappao'')-, (sp-4-2)-, 1,1-cyclobutanedicarboxylate (1:1)

    10. Db-119035

    11. Cis-diammine(1,1-cyclobutanedicarboxylate)platinum(ii)

    12. Q19776556

    13. Azane;cyclobutane-1,1-dicarboxylate;cyclobutane-1,1-dicarboxylic Acid;platinum(2+)

    14. 1,1-cyclobutanedicarboxylic Acid, Compd. With (sp-4-2)-diammine(1,1-cyclobutanedi(carboxylato-.kappa.o)(2-))platinum (1:1)

    15. Platinum, Diammine(1,1-cyclobutanedi(carboxylato-.kappa.o)(2-))-, (sp-4-2)-, 1,1-cyclobutanedicarboxylate (1:1)

    16. Platinum, Diammine(1,1-cyclobutanedicarboxylato(2-)-.kappa.o,.kappa.o'')-, (sp-4-2)-, 1,1-cyclobutanedicarboxylate (1:1)

    2.4 Create Date
    2009-12-07
    3 Chemical and Physical Properties
    Molecular Weight 515.38 g/mol
    Molecular Formula C12H20N2O8Pt
    Hydrogen Bond Donor Count4
    Hydrogen Bond Acceptor Count10
    Rotatable Bond Count2
    Exact Mass515.086760 g/mol
    Monoisotopic Mass515.086760 g/mol
    Topological Polar Surface Area157 Ų
    Heavy Atom Count23
    Formal Charge0
    Complexity317
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count5
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