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    Cloperidone Hydrochloride

    INTERMEDIATES

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    2D Structure
    Also known as: Cloperidone hcl, Ma 1337, 525-26-8, Cloperidone hydrochloride [usan], Nsc-198100, Ma-1337
    Molecular Formula
    C21H24Cl2N4O2
    Molecular Weight
    435.3  g/mol
    InChI Key
    QUGOVTRSGWYKSQ-UHFFFAOYSA-N
    FDA UNII
    17682058OP
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    3-[3-[4-(3-chlorophenyl)piperazin-1-yl]propyl]-1H-quinazoline-2,4-dione;hydrochloride
    2.1.2 InChI
    InChI=1S/C21H23ClN4O2.ClH/c22-16-5-3-6-17(15-16)25-13-11-24(12-14-25)9-4-10-26-20(27)18-7-1-2-8-19(18)23-21(26)28;/h1-3,5-8,15H,4,9-14H2,(H,23,28);1H
    2.1.3 InChI Key
    QUGOVTRSGWYKSQ-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C1CN(CCN1CCCN2C(=O)C3=CC=CC=C3NC2=O)C4=CC(=CC=C4)Cl.Cl
    2.2 Other Identifiers
    2.2.1 UNII
    17682058OP
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. Cloperidone Hcl

    2. Ma 1337

    3. 525-26-8

    4. Cloperidone Hydrochloride [usan]

    5. Nsc-198100

    6. Ma-1337

    7. 17682058op

    8. 2,4(1h,3h)-quinazolinedione, 3-(3-(4-(3-chlorophenyl)-1-piperazinyl)propyl)-, Monohydrochloride

    9. Cloperidone Hydrochloride (usan)

    10. Nsc198100

    11. Nsc 198100

    12. Unii-17682058op

    13. 3-(3-(4-(m-chlorophenyl)-1-piperazinyl)propyl)-2,4(1h,3h)-quinazolinedione Hydrochloride

    14. 3-(3-(4-(m-chlorophenyl)-1-piperazinyl)propyl)-2,4-(1h,3h)-quinazolinedione Monohydrochloride

    15. Schembl122569

    16. Chembl2106069

    17. Dtxsid20200500

    18. D03558

    19. Q27251877

    20. 2,3h)-quinazolinedione, 3-[3-[4-(3-chlorophenyl)-1-piperazinyl]propyl]-, Monohydrochloride

    21. 2,3h)-quinazolinedione, 3-[3-[4-(m-chlorophenyl)-1-piperazinyl]propyl]-, Monohydrochloride

    22. 3-[3-[4-(3-chlorophenyl)piperazin-1-yl]propyl]-1h-quinazoline-2,4-dione;hydrochloride

    23. 3-[3-[4-(m-chlorophenyl)-1-piperazinyl]propyl]-2,3h)-quinazolinedione Monohydrochloride

    2.4 Create Date
    2005-08-08
    3 Chemical and Physical Properties
    Molecular Weight 435.3 g/mol
    Molecular Formula C21H24Cl2N4O2
    Hydrogen Bond Donor Count2
    Hydrogen Bond Acceptor Count4
    Rotatable Bond Count5
    Exact Mass434.1276314 g/mol
    Monoisotopic Mass434.1276314 g/mol
    Topological Polar Surface Area55.9 Ų
    Heavy Atom Count29
    Formal Charge0
    Complexity567
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count2