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    Technical details about CAS 143322-57-0, learn more about the structure, uses, toxicity, action, side effects and more

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    CAS 143322-57-0

    BUILDING BLOCK

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    2D Structure
    Also known as: 143322-57-0, (r)-5-bromo-3-((1-methylpyrrolidin-2-yl)methyl)-1h-indole, 5-bromo-3-[[(2r)-1-methylpyrrolidin-2-yl]methyl]-1h-indole, (r)-5-bromo-3-(1-methyl-pyrrolidin-2-ylmethyl)-1h-indole, Intermediate of eletriptan, Xr1ns522cp
    Molecular Formula
    C14H17BrN2
    Molecular Weight
    293.20  g/mol
    InChI Key
    JCXOJXALBTZEFE-GFCCVEGCSA-N
    FDA UNII
    XR1NS522CP
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    5-bromo-3-[[(2R)-1-methylpyrrolidin-2-yl]methyl]-1H-indole
    2.1.2 InChI
    InChI=1S/C14H17BrN2/c1-17-6-2-3-12(17)7-10-9-16-14-5-4-11(15)8-13(10)14/h4-5,8-9,12,16H,2-3,6-7H2,1H3/t12-/m1/s1
    2.1.3 InChI Key
    JCXOJXALBTZEFE-GFCCVEGCSA-N
    2.1.4 Canonical SMILES
    CN1CCCC1CC2=CNC3=C2C=C(C=C3)Br
    2.1.5 Isomeric SMILES
    CN1CCC[C@@H]1CC2=CNC3=C2C=C(C=C3)Br
    2.2 Other Identifiers
    2.2.1 UNII
    XR1NS522CP
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. 143322-57-0

    2. (r)-5-bromo-3-((1-methylpyrrolidin-2-yl)methyl)-1h-indole

    3. 5-bromo-3-[[(2r)-1-methylpyrrolidin-2-yl]methyl]-1h-indole

    4. (r)-5-bromo-3-(1-methyl-pyrrolidin-2-ylmethyl)-1h-indole

    5. Intermediate Of Eletriptan

    6. Xr1ns522cp

    7. (r)-5-bromo-3-(n-methylpyrrolidin-2-ylmethyl)-1h-indole

    8. (r)-5-bromo-3-(n-methylpyrrolidine-2-ylmethyl)-1h-indole

    9. 5-bromo-3-[1-methylpyrrolidin-2(r)-ylmethyl]-1h-indole

    10. 1h-indole, 5-bromo-3-[[(2r)-1-methyl-2-pyrrolidinyl]methyl]-

    11. 5-bromo-3-[[(2r)-1-methyl-2-pyrrolidinyl]methyl]-1h-indole

    12. 5-bromo-3-(1-methylpyrrolidin-2(r)-ylmethyl)-1h-indole

    13. (r)-5-bromo-3-[(1-methylpyrrolidin-2-yl)methyl]-1h-indole

    14. 5-bromo-3-{[(2r)-1-methylpyrrolidin-2-yl]methyl}-1h-indole

    15. Mfcd00912970

    16. 1h-indole, 5-bromo-3-(((2r)-1-methyl-2-pyrrolidinyl)methyl)-

    17. R-5-bromo-3-(n-methylpyrrolidin-2-ylmethyl)-1h-indole

    18. (r)-5-bromo-3-(1-methyl-2-pyrrolidinyl Methyl)-1h-indole

    19. Unii-xr1ns522cp

    20. Ec 422-390-5

    21. Schembl697582

    22. Dtxsid80458106

    23. Act04784

    24. Bcp17560

    25. Cs-b0001

    26. Zinc3779249

    27. Akos015834491

    28. Akos015895955

    29. Am84391

    30. Ds-15028

    31. Eletriptan Bromo Analog [usp Impurity]

    32. Eletriptan Related Compound B [usp-rs]

    33. V10027

    34. 322b570

    35. Eletriptan Related Compound B [usp Impurity]

    36. J-502238

    37. 5-bromo-3-(1-methyl Pyrrolidin-2-yl Methyl)

    38. 5-bromo-3-(1-methypyrrolidin-2(r)-ylmethyl)-1h-indole

    39. 6-bromo-3-[(1-methylpyrrolidin-2-yl)methyl]-1h-indole

    40. (r)-5-bromo-3-(1-methyl-2-pyrrolidinylmethyl)-1h-indole

    41. (r)-5-bromo-3-(n-methylpyrrolidin-2-yl-methyl)-1h-indole

    42. (r)-5-bromo-3-(n-methylpyrrolidin-2ylmethyl)-1h-indole

    43. 3-(n-methyl-2(r)-pyrrolidinylmethyl)-5-bromo-1h-indole

    44. 5-bromo-3-(n-methyl-2(r)-pyrrolidinylmethyl)-1h-indole

    45. (r)-5-bromo-3-[(n-methylpyrrolidin-2-yl)methyl] 1 H-indole

    46. (r)-5-bromo-3-[(n-methylpyrrolidin-2-yl)methyl]-1h-indole

    47. 5-bromo-3-((r)-1-methyl-pyrrolidin-2-ylmethyl)-1h-indole

    48. 5-bromo-3-(1-methyl Pyrrolidin-2(r)-yl Methyl)-1h-indole

    49. 1h-indole,5-bromo-3-[[(2s)-1-methyl-2-pyrrolidinyl]methyl]-

    50. 5-bromo-3-((1-methylpyrrolidin-2-yl)methyl)-1h-indole, (r)-

    51. (r)-5-bromo-3-[(1-methylpyrrolidin-2-yl)methyl]-1h-indole 100 Microg/ml In Acetonitrile

    52. 5-bromo-3-(1-methylpyrrolidin-2(r)-ylmethyl)-1h-indole;(r)-5-bromo-3-[(1-methyl-2-pyrrolidinyl)methyl]-1h-indole

    2.4 Create Date
    2006-10-26
    3 Chemical and Physical Properties
    Molecular Weight 293.20 g/mol
    Molecular Formula C14H17BrN2
    XLogP33.6
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count1
    Rotatable Bond Count2
    Exact Mass292.05751 g/mol
    Monoisotopic Mass292.05751 g/mol
    Topological Polar Surface Area19 Ų
    Heavy Atom Count17
    Formal Charge0
    Complexity271
    Isotope Atom Count0
    Defined Atom Stereocenter Count1
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1