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    Etanidazole

    PharmaCompass
    Xls

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    2D Structure
    Also known as: 22668-01-5, Radinyl, Etanidazol, 1h-imidazole-1-acetamide, n-(2-hydroxyethyl)-2-nitro-, Etanidazolum, Etandazole
    Molecular Formula
    C7H10N4O4
    Molecular Weight
    214.18  g/mol
    InChI Key
    WCDWBPCFGJXFJZ-UHFFFAOYSA-N
    FDA UNII
    30DKA3Q1HL
    A nitroimidazole that sensitizes hypoxic tumor cells that are normally resistant to radiation therapy.
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    N-(2-hydroxyethyl)-2-(2-nitroimidazol-1-yl)acetamide
    2.1.2 InChI
    InChI=1S/C7H10N4O4/c12-4-2-8-6(13)5-10-3-1-9-7(10)11(14)15/h1,3,12H,2,4-5H2,(H,8,13)
    2.1.3 InChI Key
    WCDWBPCFGJXFJZ-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C1=CN(C(=N1)[N+](=O)[O-])CC(=O)NCCO
    2.2 Other Identifiers
    2.2.1 UNII
    30DKA3Q1HL
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. Nsc 301467

    2. Nsc-301467

    3. Nsc301467

    4. Sr 2508

    5. Sr-2508

    6. Sr2508

    2.3.2 Depositor-Supplied Synonyms

    1. 22668-01-5

    2. Radinyl

    3. Etanidazol

    4. 1h-imidazole-1-acetamide, N-(2-hydroxyethyl)-2-nitro-

    5. Etanidazolum

    6. Etandazole

    7. Nsc-301467

    8. Sr 2508

    9. Sr-2508

    10. N-(2-hydroxyethyl)-2-nitro-1h-imidazole-1-acetamide

    11. N-(2-hydroxyethyl)-2-(2-nitro-1h-imidazol-1-yl)acetamide

    12. N-(2-hydroxyethyl)-2-nitroimidazole-1-acetamide

    13. Nsc301467

    14. 30dka3q1hl

    15. N-(2-hydroxyethyl)-1-(2-nitro-1-imidazolyl)acetamide

    16. N-(2-hydroxyethyl)-2-(2-nitroimidazol-1-yl)acetamide

    17. Mls003115757

    18. Chebi:75473

    19. Ncgc00016767-02

    20. Ethanidazole

    21. Cas-22668-01-5

    22. Dsstox_cid_25434

    23. Dsstox_rid_80876

    24. Dsstox_gsid_45434

    25. Etanidazol [spanish]

    26. Etanidazolum [latin]

    27. Etanidazole [usan:inn]

    28. Nsc 301467

    29. Sr-05000001859

    30. Unii-30dka3q1hl

    31. Brn 0919296

    32. Etanidazole-d4

    33. Radinyl(tm)

    34. Radinyl (tn)

    35. Prestwick_1056

    36. Spectrum_001574

    37. Etanidazole [mi]

    38. Prestwick0_000649

    39. Prestwick1_000649

    40. Prestwick2_000649

    41. Prestwick3_000649

    42. Spectrum2_000910

    43. Spectrum4_001183

    44. Spectrum5_001667

    45. Etanidazole [inn]

    46. Etanidazole (usan/inn)

    47. Etanidazole [usan]

    48. Etanidazole (sr-2508)

    49. Schembl4414

    50. Etanidazole [mart.]

    51. Bspbio_000657

    52. Kbiogr_001845

    53. Kbioss_002054

    54. Chembl47405

    55. Divk1c_000305

    56. Spectrum1503412

    57. Dup-435

    58. Spbio_000760

    59. Spbio_002578

    60. Bpbio1_000723

    61. Dtxsid8045434

    62. Schembl20836613

    63. Schembl22493013

    64. Hms500p07

    65. Kbio1_000305

    66. Kbio2_002054

    67. Kbio2_004622

    68. Kbio2_007190

    69. Ninds_000305

    70. Hms1570a19

    71. Hms2093e13

    72. Hms2097a19

    73. Hms3714a19

    74. Xaa66801

    75. Zinc1873938

    76. Tox21_110599

    77. Ccg-39747

    78. Ethylhydrocupreinehydrochloride

    79. Akos028109842

    80. Tox21_110599_1

    81. Db12736

    82. Sp-2508

    83. Idi1_000305

    84. Ncgc00016767-01

    85. Ncgc00016767-05

    86. Ncgc00095848-01

    87. Nci60_002528

    88. Smr001233273

    89. Sbi-0051823.p002

    90. Ab00052354

    91. D04075

    92. 2-nitroimidazole-1-acetamide, N-(2-hydroxyethyl)-

    93. Q5402427

    94. Sr-05000001859-1

    95. Sr-05000001859-2

    96. 2-(2-nitro-imidazol-1-yl)-n-2-hydroxyethylacetamide

    97. N-(2-hydroxyethyl)-2-(2-nitro-1-imidazolyl)acetamide

    2.4 Create Date
    2005-03-25
    3 Chemical and Physical Properties
    Molecular Weight 214.18 g/mol
    Molecular Formula C7H10N4O4
    XLogP3-1.3
    Hydrogen Bond Donor Count2
    Hydrogen Bond Acceptor Count5
    Rotatable Bond Count4
    Exact Mass214.07020481 g/mol
    Monoisotopic Mass214.07020481 g/mol
    Topological Polar Surface Area113 Ų
    Heavy Atom Count15
    Formal Charge0
    Complexity242
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
    4 Pharmacology and Biochemistry
    4.1 MeSH Pharmacological Classification

    Radiation-Sensitizing Agents

    Drugs used to potentiate the effectiveness of radiation therapy in destroying unwanted cells. (See all compounds classified as Radiation-Sensitizing Agents.)

    Antineoplastic Agents

    Substances that inhibit or prevent the proliferation of NEOPLASMS. (See all compounds classified as Antineoplastic Agents.)