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    Chemistry

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    Also known as: (s)-cloperastine, 132301-89-4, 1-[2-[(s)-(4-chlorophenyl)-phenylmethoxy]ethyl]piperidine, 99v54164fc, Unii-99v54164fc, L-cloperastine
    Molecular Formula
    C20H24ClNO
    Molecular Weight
    329.9  g/mol
    InChI Key
    FLNXBVJLPJNOSI-FQEVSTJZSA-N
    FDA UNII
    99V54164FC
    Levocloperastine
    1 2D Structure

    Levocloperastine

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    1-[2-[(S)-(4-chlorophenyl)-phenylmethoxy]ethyl]piperidine
    2.1.2 InChI
    InChI=1S/C20H24ClNO/c21-19-11-9-18(10-12-19)20(17-7-3-1-4-8-17)23-16-15-22-13-5-2-6-14-22/h1,3-4,7-12,20H,2,5-6,13-16H2/t20-/m0/s1
    2.1.3 InChI Key
    FLNXBVJLPJNOSI-FQEVSTJZSA-N
    2.1.4 Canonical SMILES
    C1CCN(CC1)CCOC(C2=CC=CC=C2)C3=CC=C(C=C3)Cl
    2.1.5 Isomeric SMILES
    C1CCN(CC1)CCO[C@@H](C2=CC=CC=C2)C3=CC=C(C=C3)Cl
    2.2 Other Identifiers
    2.2.1 UNII
    99V54164FC
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. (s)-cloperastine

    2. 132301-89-4

    3. 1-[2-[(s)-(4-chlorophenyl)-phenylmethoxy]ethyl]piperidine

    4. 99v54164fc

    5. Unii-99v54164fc

    6. L-cloperastine

    7. Ncgc00016711-01

    8. Cas-14984-68-0

    9. Chembl1516068

    10. Zinc57251

    11. Levocloperastine [who-dd]

    12. Q27272245

    13. Piperidine, 1-(2-((s)-(4-chlorophenyl)phenylmethoxy)ethyl)-

    2.4 Create Date
    2005-07-07
    3 Chemical and Physical Properties
    Molecular Weight 329.9 g/mol
    Molecular Formula C20H24ClNO
    XLogP34.8
    Hydrogen Bond Donor Count0
    Hydrogen Bond Acceptor Count2
    Rotatable Bond Count6
    Exact Mass329.1546421 g/mol
    Monoisotopic Mass329.1546421 g/mol
    Topological Polar Surface Area12.5 Ų
    Heavy Atom Count23
    Formal Charge0
    Complexity318
    Isotope Atom Count0
    Defined Atom Stereocenter Count1
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1

    API Reference Price

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    09-Aug-2021
    01-Mar-2024
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