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    Iomeprol

    ACTIVE PHARMA INGREDIENTS

    INTERMEDIATES

    FINISHED DOSAGE FORMULATIONS

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    2D Structure
    Also known as: 78649-41-9, Iomeprolum, Iomeron, Imeron, Iomeron 300, N,n'-bis(2,3-dihydroxypropyl)-2,4,6-triiodo-5-(n-methylglycolamido)isophthalamide
    Molecular Formula
    C17H22I3N3O8
    Molecular Weight
    777.1  g/mol
    InChI Key
    NJKDOADNQSYQEV-UHFFFAOYSA-N
    FDA UNII
    17E17JBP8L
    Iomeprol has been investigated for the diagnostic of Coronary Artery Disease.
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    1-N,3-N-bis(2,3-dihydroxypropyl)-5-[(2-hydroxyacetyl)-methylamino]-2,4,6-triiodobenzene-1,3-dicarboxamide
    2.1.2 InChI
    InChI=1S/C17H22I3N3O8/c1-23(9(29)6-26)15-13(19)10(16(30)21-2-7(27)4-24)12(18)11(14(15)20)17(31)22-3-8(28)5-25/h7-8,24-28H,2-6H2,1H3,(H,21,30)(H,22,31)
    2.1.3 InChI Key
    NJKDOADNQSYQEV-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CN(C1=C(C(=C(C(=C1I)C(=O)NCC(CO)O)I)C(=O)NCC(CO)O)I)C(=O)CO
    2.2 Other Identifiers
    2.2.1 UNII
    17E17JBP8L
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. Imeron

    2. Iomeprol 350

    3. Iomeprol 400

    4. Iomeron

    2.3.2 Depositor-Supplied Synonyms

    1. 78649-41-9

    2. Iomeprolum

    3. Iomeron

    4. Imeron

    5. Iomeron 300

    6. N,n'-bis(2,3-dihydroxypropyl)-2,4,6-triiodo-5-(n-methylglycolamido)isophthalamide

    7. N1,n3-bis(2,3-dihydroxypropyl)-5-(2-hydroxy-n-methylacetamido)-2,4,6-triiodoisophthalamide

    8. E-7337

    9. 1-n,3-n-bis(2,3-dihydroxypropyl)-5-[(2-hydroxyacetyl)-methylamino]-2,4,6-triiodobenzene-1,3-dicarboxamide

    10. 17e17jbp8l

    11. 1185146-41-1

    12. Chebi:31710

    13. N,n'-bis(2,3-dihydroxypropyl)-5-[glycoloyl(methyl)amino]-2,4,6-triiodoisophthalamide

    14. Ncgc00183283-01

    15. Iomeprolo

    16. E7337

    17. 1,3-benzenedicarboxamide, N,n'-bis(2,3-dihydroxypropyl)-5-((hydroxyacetyl)methylamino)-2,4,6-triiodo-

    18. Iomeprolum [inn-latin]

    19. Unii-17e17jbp8l

    20. Iomeprol [usan:inn:ban:jan]

    21. Iomeprol [usan]

    22. Iomeprol [inn]

    23. Iomeprol [jan]

    24. Iomeprol [mi]

    25. Iomeron 300 (tn)

    26. Iomeprol [mart.]

    27. Iomeprol [who-dd]

    28. Dsstox_cid_28987

    29. Dsstox_rid_83252

    30. Dsstox_gsid_49061

    31. Schembl26981

    32. Iomeprol (jan/usan/inn)

    33. Chembl2107214

    34. Dtxsid1049061

    35. Bcp34386

    36. Tox21_113611

    37. Akos030255901

    38. Db11705

    39. Ac-30722

    40. Cas-78649-41-9

    41. Db-056324

    42. Ft-0627277

    43. Ft-0670399

    44. Methylacetamido)-2,4,6-triiodoisophthalamide

    45. D01719

    46. Iomeprol 100 Microg/ml In Acetonitrile/methanol

    47. Iomeprol 100 Microg/ml In Acetonitrile:methanol

    48. A839467

    49. B-16880

    50. N1,n3-bis(2,3-dihydroxypropyl)-5-(2-hydroxy-n-

    51. Q6062808

    52. 1,3-benzenedicarboxamide, N1,n3-bis(2,3-dihydroxypropyl)-5-[(2-hydroxyacetyl)methylamino]-2,4,6-triiodo-

    2.4 Create Date
    2005-03-25
    3 Chemical and Physical Properties
    Molecular Weight 777.1 g/mol
    Molecular Formula C17H22I3N3O8
    XLogP3-2.3
    Hydrogen Bond Donor Count7
    Hydrogen Bond Acceptor Count8
    Rotatable Bond Count10
    Exact Mass776.8541 g/mol
    Monoisotopic Mass776.8541 g/mol
    Topological Polar Surface Area180 Ų
    Heavy Atom Count31
    Formal Charge0
    Complexity591
    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 MeSH Pharmacological Classification

    Contrast Media

    Substances used to allow enhanced visualization of tissues. (See all compounds classified as Contrast Media.)

    4.2 ATC Code

    V08AB10

    S76 | LUXPHARMA | Pharmaceuticals Marketed in Luxembourg | Pharmaceuticals marketed in Luxembourg, as published by d'Gesondheetskeess (CNS, la caisse nationale de sante, www.cns.lu), mapped by name to structures using CompTox by R. Singh et al. (in prep.). List downloaded from https://cns.public.lu/en/legislations/textes-coordonnes/liste-med-comm.html. Dataset DOI:10.5281/zenodo.4587355

    V - Various

    V08 - Contrast media

    V08A - X-ray contrast media, iodinated

    V08AB - Watersoluble, nephrotropic, low osmolar x-ray contrast media

    V08AB10 - Iomeprol