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    Technical details about Prestwick2_001071, learn more about the structure, uses, toxicity, action, side effects and more

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    Prestwick2_001071

    PRICE INFORMATION

    ANALYTICAL SOLUTION(s)

    PharmaCompass

    Minakem offers CDMO services for API & HPAPI, generics, regulatory expertise, track record performance & FDA & GMP certifications.

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    2D Structure
    1. Also known as: Imidurea, 39236-46-9, 1,1'-methylenebis(3-(3-(hydroxymethyl)-2,5-dioxoimidazolidin-4-yl)urea), Germall 115, Imidurea [nf], 1-[3-(hydroxymethyl)-2,5-dioxoimidazolidin-4-yl]-3-[[[3-(hydroxymethyl)-2,5-dioxoimidazolidin-4-yl]carbamoylamino]methyl]urea
    Molecular Formula
    C11H16N8O8
    Molecular Weight
    388.29  g/mol
    InChI Key
    ZCTXEAQXZGPWFG-UHFFFAOYSA-N
    FDA UNII
    M629807ATL
    Imidurea is an antimicrobial preservative used in cosmetics. It acts as a formaldehyde releaser.
    Imidurea is a Standardized Chemical Allergen. The physiologic effect of imidurea is by means of Increased Histamine Release, and Cell-mediated Immunity.
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    1-[3-(hydroxymethyl)-2,5-dioxoimidazolidin-4-yl]-3-[[[3-(hydroxymethyl)-2,5-dioxoimidazolidin-4-yl]carbamoylamino]methyl]urea
    2.1.2 InChI
    InChI=1S/C11H16N8O8/c20-2-18-4(6(22)16-10(18)26)14-8(24)12-1-13-9(25)15-5-7(23)17-11(27)19(5)3-21/h4-5,20-21H,1-3H2,(H2,12,14,24)(H2,13,15,25)(H,16,22,26)(H,17,23,27)
    2.1.3 InChI Key
    ZCTXEAQXZGPWFG-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C(NC(=O)NC1C(=O)NC(=O)N1CO)NC(=O)NC2C(=O)NC(=O)N2CO
    2.2 Other Identifiers
    2.2.1 UNII
    M629807ATL
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. Germall 115

    2. Imidazolidinyl Urea, Monosodium Salt

    3. Imidazolidinylurea

    2.3.2 Depositor-Supplied Synonyms

    1. Imidurea

    2. 39236-46-9

    3. 1,1'-methylenebis(3-(3-(hydroxymethyl)-2,5-dioxoimidazolidin-4-yl)urea)

    4. Germall 115

    5. Imidurea [nf]

    6. 1-[3-(hydroxymethyl)-2,5-dioxoimidazolidin-4-yl]-3-[[[3-(hydroxymethyl)-2,5-dioxoimidazolidin-4-yl]carbamoylamino]methyl]urea

    7. Methanebis(n,n'-(5-ureido-2,4-diketotetrahydroimidazole)-n,n-dimethylol)

    8. Mls002154142

    9. Chebi:51805

    10. M629807atl

    11. Imidurea (nf)

    12. Ncgc00164388-01

    13. Smr001233448

    14. N',n'''-methanediylbis{1-[3-(hydroxymethyl)-2,5-dioxoimidazolidin-4-yl]urea}

    15. N,n''-methylenebis(n'-(3-(hydroxymethyl)-2,5-dioxo-4-imidazolidinyl)urea)

    16. Dsstox_cid_20151

    17. Dsstox_rid_79449

    18. Dsstox_gsid_40151

    19. Imidazolinidyl Urea

    20. Einecs 254-372-6

    21. Unii-m629807atl

    22. N,n''-methylenebis(n'-(1-(hydroxymethyl)-2,5-dioxo-4-imidazolidinyl)urea)

    23. Cas-39236-46-9

    24. Mfcd00221482

    25. Imidurea [ii]

    26. Imidurea [mi]

    27. Imidurea [vandf]

    28. Prestwick0_001071

    29. Prestwick1_001071

    30. Prestwick2_001071

    31. Prestwick3_001071

    32. Imidurea [mart.]

    33. Imidurea [usp-rs]

    34. 1,1'-methylenebis(3-(3-(hydroxymethyl)-2,5-dioxo-4-imidazolidinyl)urea)

    35. Ec 254-372-6

    36. Urea, N,n''-methylenebis(n'-(3-(hydroxymethyl)-2,5-dioxo-4-imidazolidinyl)-

    37. Schembl34461

    38. Bspbio_001082

    39. Cid_38258

    40. Chembl65433

    41. Spbio_002991

    42. Bpbio1_001192

    43. Dtxsid2040151

    44. Bdbm66981

    45. Hms1571g04

    46. Hms2098g04

    47. Hms2230o16

    48. Hms3369e04

    49. Hms3715g04

    50. Imidazolidinyl Urea [inci]

    51. Imidazolidinyl Urea [vandf]

    52. Hy-b1158

    53. Tox21_112112

    54. Tox21_302325

    55. S5212

    56. Akos015895558

    57. N,n''-methylenebis(n'-(3-(hydroxymethyl)-2,5-dioxo-4-imidazolidin- Yl)urea

    58. N,n''-methylenebis(n'-(3-(hydroxymethyl)-2,5-dioxoimidazolidin-4-yl)urea)

    59. N,n'-methylenebis(n'-(3-(hydroxymethyl)-2,5-dioxo-4-imidazolidinyl)urea)

    60. N,n'-methylenebis[n'-(3-hydroxymethyl-2,5-dioxo-4-imidazolidinyl)urea]

    61. N,n'-methylenebis[n'-[3-(hydroxymethyl)-2,5-dioxo-4-imidazolidinyl]-urea

    62. Urea, N,n''-methylenebis(n'-(1-(hydroxymethyl)-2,5-dioxo-4-imidazolidinyl)-

    63. Ccg-221071

    64. Cs-4609

    65. Db14075

    66. S10971

    67. Urea, N,n''-methylenebis(n'-(3-(hydroxymethyl)-2,5-dioxo-4-imidazolidin- Yl)-

    68. Ncgc00179313-01

    69. Ncgc00179313-03

    70. Ncgc00179313-05

    71. Ncgc00255574-01

    72. 1-[3-(hydroxymethyl)-2,5-dioxoimidazolidin-4-yl]-3-[[[3-(hydroxymethyl)-2,5-dioxoimidazolidin-4-yl]c

    73. As-15260

    74. Ab00514030

    75. Ft-0658132

    76. I0665

    77. D04513

    78. Sr-01000841816

    79. Q2737856

    80. Sr-01000841816-2

    81. Imidurea, United States Pharmacopeia (usp) Reference Standard

    82. Imidurea, Pharmaceutical Secondary Standard; Certified Reference Material

    83. N,n"-methylenebis[n"-[3-(hydroxymethyl)-2,5-dioxo-4-imidazolidinyl]urea]

    84. N,n-methylenebis N'-1-(hydroxymethyl)-2,5-dioxo-4-imidazolidinyl Urea

    85. 1,1'-methylenebis(3-(3-(hydroxymethyl)-2,5-dioxo-4-imidazolidinyl)urea

    86. 1-(2,5-diketo-3-methylol-imidazolidin-4-yl)-3-[[(2,5-diketo-3-methylol-imidazolidin-4-yl)carbamoylamino]methyl]urea

    87. 1-[3-(hydroxymethyl)-2,5-bis(oxidanylidene)imidazolidin-4-yl]-3-[[[3-(hydroxymethyl)-2,5-bis(oxidanylidene)imidazolidin-4-yl]carbamoylamino]methyl]urea

    88. 1-[3-(hydroxymethyl)-2,5-dioxo-4-imidazolidinyl]-3-[[[[[3-(hydroxymethyl)-2,5-dioxo-4-imidazolidinyl]amino]-oxomethyl]amino]methyl]urea

    89. 1-[3-(hydroxymethyl)-2,5-dioxo-imidazolidin-4-yl]-3-[[[3-(hydroxymethyl)-2,5-dioxo-imidazolidin-4-yl]carbamoylamino]methyl]urea

    90. 3-[3-(hydroxymethyl)-2,5-dioxoimidazolidin-4-yl]-1-[({[3-(hydroxymethyl)-2,5-dioxoimidazolidin-4-yl]carbamoyl}amino)methyl]urea

    2.4 Create Date
    2005-07-19
    3 Chemical and Physical Properties
    Molecular Weight 388.29 g/mol
    Molecular Formula C11H16N8O8
    XLogP3-3.4
    Hydrogen Bond Donor Count8
    Hydrogen Bond Acceptor Count8
    Rotatable Bond Count6
    Exact Mass388.10910950 g/mol
    Monoisotopic Mass388.10910950 g/mol
    Topological Polar Surface Area222 Ų
    Heavy Atom Count27
    Formal Charge0
    Complexity627
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count2
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
    4 Pharmacology and Biochemistry
    4.1 FDA Pharmacological Classification
    4.1.1 Active Moiety
    IMIDUREA
    4.1.2 FDA UNII
    M629807ATL
    4.1.3 Pharmacological Classes
    Chemical Structure [CS] - Allergens
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