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

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    Selonabant

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    Biophore is a research-driven global pharmaceutical company focused on niche APIs for the generic industry.

    Athena Pharmaceutiques is a Partner of Choice for Drug Delivery & Life Cycle Management.

    2D Structure
    1. Also known as: Aneb-001, Aneb 001, 1-azetidinecarboxamide, 3-((r)-(4-chlorophenyl)(2-(trifluoromethyl)phenyl)methoxy)-n-(1,1-dimethylethyl)-, 3-((r)-(4-chlorophenyl)(2-(trifluoromethyl)phenyl)methoxy)-n-(1,1-dimethylethyl)-1-azetidinecarboxamide, 791848-71-0, Unii-4rnu8c6xxw
    Molecular Formula
    C22H24ClF3N2O2
    Molecular Weight
    440.9  g/mol
    InChI Key
    BNLYOVHLLDBOFZ-LJQANCHMSA-N
    FDA UNII
    4RNU8C6XXW
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    N-tert-butyl-3-[(R)-(4-chlorophenyl)-[2-(trifluoromethyl)phenyl]methoxy]azetidine-1-carboxamide
    2.1.2 InChI
    InChI=1S/C22H24ClF3N2O2/c1-21(2,3)27-20(29)28-12-16(13-28)30-19(14-8-10-15(23)11-9-14)17-6-4-5-7-18(17)22(24,25)26/h4-11,16,19H,12-13H2,1-3H3,(H,27,29)/t19-/m1/s1
    2.1.3 InChI Key
    BNLYOVHLLDBOFZ-LJQANCHMSA-N
    2.1.4 Canonical SMILES
    CC(C)(C)NC(=O)N1CC(C1)OC(C2=CC=C(C=C2)Cl)C3=CC=CC=C3C(F)(F)F
    2.1.5 Isomeric SMILES
    CC(C)(C)NC(=O)N1CC(C1)O[C@H](C2=CC=C(C=C2)Cl)C3=CC=CC=C3C(F)(F)F
    2.2 Other Identifiers
    2.2.1 UNII
    4RNU8C6XXW
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. Aneb-001

    2. Aneb 001

    3. 1-azetidinecarboxamide, 3-((r)-(4-chlorophenyl)(2-(trifluoromethyl)phenyl)methoxy)-n-(1,1-dimethylethyl)-

    4. 3-((r)-(4-chlorophenyl)(2-(trifluoromethyl)phenyl)methoxy)-n-(1,1-dimethylethyl)-1-azetidinecarboxamide

    5. 791848-71-0

    6. Unii-4rnu8c6xxw

    7. Schembl4075847

    8. Hy-148176

    9. Cs-0614842

    10. N-tert-butyl-3-[(r)-(4-chlorophenyl)-[2-(trifluoromethyl)phenyl]methoxy]azetidine-1-carboxamide

    2.4 Create Date
    2012-11-30
    3 Chemical and Physical Properties
    Molecular Weight 440.9 g/mol
    Molecular Formula C22H24ClF3N2O2
    XLogP34.9
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count5
    Rotatable Bond Count5
    Exact Mass440.1478402 g/mol
    Monoisotopic Mass440.1478402 g/mol
    Topological Polar Surface Area41.6 Ų
    Heavy Atom Count30
    Formal Charge0
    Complexity582
    Isotope Atom Count0
    Defined Atom Stereocenter Count1
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
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