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    Technical details about DSSTox_CID_28894, learn more about the structure, uses, toxicity, action, side effects and more

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    DSSTox_CID_28894

    APIs // Active Pharmaceutical Ingredients

    PharmaCompass

    Phyton is a World Leader in Plant Cell Fermentation Technology and Commercial Manufacturing.

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

    2D Structure
    1. Also known as: 7082-21-5, Terodiline (hydrochloride), Bicor, Terodiline hydrochloride [usan], K2za89w43f, N-t-butyl-1-methyl-3,3-diphenylpropylamine hydrochloride
    Molecular Formula
    C20H28ClN
    Molecular Weight
    317.9  g/mol
    InChI Key
    RNGHAJVBYQPLAZ-UHFFFAOYSA-N
    FDA UNII
    K2ZA89W43F
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    N-tert-butyl-4,4-diphenylbutan-2-amine;hydrochloride
    2.1.2 InChI
    InChI=1S/C20H27N.ClH/c1-16(21-20(2,3)4)15-19(17-11-7-5-8-12-17)18-13-9-6-10-14-18;/h5-14,16,19,21H,15H2,1-4H3;1H
    2.1.3 InChI Key
    RNGHAJVBYQPLAZ-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CC(CC(C1=CC=CC=C1)C2=CC=CC=C2)NC(C)(C)C.Cl
    2.2 Other Identifiers
    2.2.1 UNII
    K2ZA89W43F
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. N-tert-butyl-1-methyl-3,3-diphenylpropylamine

    2. N-tert-butyl-3,3-diphenyl-1-methylpropylamine

    3. Td 758

    4. Td-758

    5. Terodiline

    2.3.2 Depositor-Supplied Synonyms

    1. 7082-21-5

    2. Terodiline (hydrochloride)

    3. Bicor

    4. Terodiline Hydrochloride [usan]

    5. K2za89w43f

    6. N-t-butyl-1-methyl-3,3-diphenylpropylamine Hydrochloride

    7. N-tert-butyl-1-methyl-3,3-diphenylpropylamine Hydrochloride

    8. N-tert-butyl-4,4-diphenylbutan-2-amine;hydrochloride

    9. Terodiline Chloride

    10. N-(tert-butyl)-4,4-diphenylbutan-2-amine Hydrochloride

    11. Micturin

    12. Micturol

    13. Terodiline Hcl

    14. Ncgc00183030-01

    15. Td-758

    16. Unii-k2za89w43f

    17. Propylamine, N-tert-butyl-1-methyl-3,3-diphenyl-, Hydrochloride

    18. Dsstox_cid_28894

    19. Dsstox_rid_83162

    20. Dsstox_gsid_48968

    21. Mls004712058

    22. Chembl539770

    23. Dtxsid1048968

    24. Chebi:32194

    25. Tox21_113412

    26. Hy-16489a

    27. Terodiline Hydrochloride (jan/usan)

    28. Terodiline Hydrochloride [mi]

    29. Terodiline Hydrochloride [jan]

    30. Benzenepropanamine, N-(1,1-dimethylethyl)-.alpha.-methyl-.gamma.-phenyl-, Hydrochloride

    31. Benzenepropanamine, N-(1,1-dimethylethyl)-alpha-methyl-gamma-phenyl-, Hydrochloride

    32. Terodiline Hydrochloride [mart.]

    33. Terodiline Hydrochloride [who-dd]

    34. Smr003475019

    35. Cas-7082-21-5

    36. Cs-0109448

    37. D01873

    38. Terodiline Hydrochloride, >=98% (hplc), Solid

    39. Q27281873

    40. (+/-)-n-tert-butyl-1-methyl-3,3-diphenylpropylamine Hydrochloride

    2.4 Create Date
    2005-06-24
    3 Chemical and Physical Properties
    Molecular Weight 317.9 g/mol
    Molecular Formula C20H28ClN
    Hydrogen Bond Donor Count2
    Hydrogen Bond Acceptor Count1
    Rotatable Bond Count6
    Exact Mass317.1910276 g/mol
    Monoisotopic Mass317.1910276 g/mol
    Topological Polar Surface Area12 Ų
    Heavy Atom Count22
    Formal Charge0
    Complexity261
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count1
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count2
    4 Pharmacology and Biochemistry
    4.1 MeSH Pharmacological Classification

    Parasympatholytics

    Agents that inhibit the actions of the parasympathetic nervous system. The major group of drugs used therapeutically for this purpose is the MUSCARINIC ANTAGONISTS. (See all compounds classified as Parasympatholytics.)

    Calcium Channel Blockers

    A class of drugs that act by selective inhibition of calcium influx through cellular membranes. (See all compounds classified as Calcium Channel Blockers.)

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