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    CAS 208260-29-1

    BUILDING BLOCK

    PharmaCompass
    Xls

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    2D Structure
    Also known as: 208260-29-1, Zm 336372, Zm336372, Zm-336372, N-[5-(3-dimethylaminobenzamido)-2-methylphenyl]-4-hydroxybenzamide, Chembl186526
    Molecular Formula
    C23H23N3O3
    Molecular Weight
    389.4  g/mol
    InChI Key
    PYEFPDQFAZNXLI-UHFFFAOYSA-N
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    3-(dimethylamino)-N-[3-[(4-hydroxybenzoyl)amino]-4-methylphenyl]benzamide
    2.1.2 InChI
    InChI=1S/C23H23N3O3/c1-15-7-10-18(24-23(29)17-5-4-6-19(13-17)26(2)3)14-21(15)25-22(28)16-8-11-20(27)12-9-16/h4-14,27H,1-3H3,(H,24,29)(H,25,28)
    2.1.3 InChI Key
    PYEFPDQFAZNXLI-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CC1=C(C=C(C=C1)NC(=O)C2=CC(=CC=C2)N(C)C)NC(=O)C3=CC=C(C=C3)O
    2.2 Synonyms
    2.2.1 MeSH Synonyms

    1. N-(5-(3-dimethylaminobenzamido)-2-methylphenyl)-4-hydroxybenzamide

    2. Zm 336372

    3. Zm-336372

    4. Zm336372

    2.2.2 Depositor-Supplied Synonyms

    1. 208260-29-1

    2. Zm 336372

    3. Zm336372

    4. Zm-336372

    5. N-[5-(3-dimethylaminobenzamido)-2-methylphenyl]-4-hydroxybenzamide

    6. Chembl186526

    7. N-(5-(3-dimethylaminobenzamido)-2-methylphenyl)-4-hydroxybenzamide

    8. 3-(dimethylamino)-n-[3-[(4-hydroxybenzoyl)amino]-4-methylphenyl]benzamide

    9. 3-(dimethylamino)- N -[3-[(4-hydroxybenzoyl)-amino]-4-methylphenyl]benzamide

    10. Benzamide, 3-(dimethylamino)-n-[3-[(4-hydroxybenzoyl)amino]-4-methylphenyl]-

    11. Bio1_001346

    12. Compound 1 [pmid: 15454231]

    13. Biomolki_000053

    14. Biomolki2_000059

    15. Bmk1-f5

    16. Bspbio_001240

    17. Kbiogr_000580

    18. Kbioss_000580

    19. Mls006011222

    20. Gtpl9130

    21. Schembl1424183

    22. Chebi:95033

    23. Kbio2_000580

    24. Kbio2_003148

    25. Kbio2_005716

    26. Kbio3_001039

    27. Kbio3_001040

    28. Dtxsid70274478

    29. Bio1_000368

    30. Bio1_000857

    31. Bio2_000460

    32. Bio2_000940

    33. Hms1362n21

    34. Hms1792n21

    35. Hms1990n21

    36. Hms3267n15

    37. Hms3403n21

    38. Hms3412g10

    39. Hms3656j17

    40. Hms3676g10

    41. Hms3750e15

    42. Zinc581684

    43. Bcp02628

    44. Ex-a4551

    45. Bdbm50153835

    46. Mfcd02683971

    47. Nsc756654

    48. Zinc00581684

    49. 3-(dimethylamino)-n-[3-[(4-hydroxybenzoyl)amino]-4-methyl-phenyl]benzamide

    50. 3-(dimethylamino)-n-[3-[(4-hydroxybenzoyl)amino]-4-methylphenyl]-benzamide

    51. Akos005266695

    52. Bcp9000021

    53. Ccg-100657

    54. Cs-0693

    55. Nsc-756654

    56. Sb19423

    57. Idi1_002215

    58. Ncgc00025109-01

    59. Ncgc00025109-02

    60. Ncgc00025109-03

    61. Ncgc00025109-04

    62. Ncgc00025109-06

    63. As-73349

    64. Hy-13343

    65. Smr004702983

    66. Ft-0675916

    67. Sw218185-2

    68. Ec-000.2459

    69. Zm 336372, >=98% (hplc)

    70. A852470

    71. Sr-01000597402

    72. J-013659

    73. Sr-01000597402-1

    74. Brd-k73789395-001-04-0

    75. Brd-k73789395-001-05-7

    76. Q27089299

    77. Zm 336372 - Cas 208260-29-1

    78. N-[5-(3-dimethylaminobenzamido)-2-methylphenyl]4-hydroxybenzamide

    79. 3-(dimethylamino)-n-[3-[(4-hydroxybenzoyl)-amino]-4-methylphenyl]benzamide

    80. 3-dimethylamino-n-[3-[(4-hydroxybenzoyl)amino]-4-methylphenyl]benzamide

    81. 1-(3-dimethylaminophenylcarboxamido)-3-(4-hydroxyphenylcarboxamido)-4-methylbenzene

    82. 3-(dimethylamino)-n-[3-[(4-hydroxybenzoyl)-amino]-4-methylphenyl]benzamide;zm336372

    83. N-{5-[3-(dimethylamino)benzamido]-2-methylphenyl}-4-hydroxybenzamide

    2.3 Create Date
    2005-03-25
    3 Chemical and Physical Properties
    Molecular Weight 389.4 g/mol
    Molecular Formula C23H23N3O3
    XLogP33.7
    Hydrogen Bond Donor Count3
    Hydrogen Bond Acceptor Count4
    Rotatable Bond Count5
    Exact Mass389.17394160 g/mol
    Monoisotopic Mass389.17394160 g/mol
    Topological Polar Surface Area81.7 Ų
    Heavy Atom Count29
    Formal Charge0
    Complexity560
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
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