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Iodixanol

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Identification
Molecular formula
C35H44I6N6O15
CAS number
92339-11-2
IUPAC name
5-[acetyl(2,3-dihydroxypropyl)amino]-N3-(2,3-dihydroxypropyl)-N1-(2-hydroxyethyl)-2,4,6-triiodo-benzene-1,3-dicarboxamide
State
State

At room temperature, Iodixanol is found as a solid in its pure form. When used diagnostically, it is often in aqueous solution form.

Melting point (Celsius)
276.00
Melting point (Kelvin)
549.00
Boiling point (Celsius)
0.00
Boiling point (Kelvin)
0.00
General information
Molecular weight
1550.20g/mol
Molar mass
1 550.2040g/mol
Density
1.6252g/cm3
Appearence

Iodixanol is a pale yellow or white, crystalline powder. It is often provided in solution form for medical use, appearing as a clear, colourless to pale yellow solution.

Comment on solubility

Solubility of 5-[acetyl(2,3-dihydroxypropyl)amino]-N3-(2,3-dihydroxypropyl)-N1-(2-hydroxyethyl)-2,4,6-triiodo-benzene-1,3-dicarboxamide

The compound 5-[acetyl(2,3-dihydroxypropyl)amino]-N3-(2,3-dihydroxypropyl)-N1-(2-hydroxyethyl)-2,4,6-triiodo-benzene-1,3-dicarboxamide (C35H44I6N6O15) exhibits unique solubility characteristics due to its complex molecular structure and the presence of multiple functional groups. Here’s a detailed overview of its solubility behavior:

  • Polarity: The numerous hydroxyl (–OH) groups suggest that the compound may exhibit polar characteristics, which can enhance its solubility in polar solvents like water.
  • Iodine Atoms: The presence of I6 in the molecular structure can introduce hydrophobic interactions, potentially limiting solubility in non-polar solvents.
  • Amide Groups: The amide functional groups may allow for hydrogen bonding, further influencing solubility in various solvents.
  • Temperature Dependency: Like many organic compounds, solubility may vary with temperature changes, potentially increasing at elevated temperatures.

In conclusion, while this compound may demonstrate a degree of solubility in polar solvents, its overall solubility profile is influenced by the balance between its polar and non-polar components. As noted, it is essential to consider specific solvent interactions and experimental conditions when evaluating solubility.

Interesting facts

Interesting Facts about 5-[acetyl(2,3-dihydroxypropyl)amino]-N3-(2,3-dihydroxypropyl)-N1-(2-hydroxyethyl)-2,4,6-triiodo-benzene-1,3-dicarboxamide

This particularly complex compound is a fascinating member of the class of chemical compounds that exemplifies the intricate nature of medicinal chemistry. Its structural features give it unique chemical properties that underpin its potential applications in various fields, particularly in pharmaceuticals and materials science. Here are some thought-provoking aspects of this compound:

  • Functional Groups: The presence of multiple functional groups such as amine and carboxamide not only enhances its reactivity but also its ability to engage in hydrogen bonding, which can significantly influence its biological activity.
  • Iodine Atoms: The three iodine atoms in the structure significantly increase its molecular weight and impact its behavior in biological systems. Iodinated compounds are often studied for their radiological properties, making them useful in medical imaging and diagnostics.
  • Hydroxypropyl Chains: Having hydroxyl groups enhances solubility and often leads to increased biological compatibility, thereby improving how the compound interacts with the body on a molecular level.
  • Applications in Drug Design: Compounds rich in iodine and with structured substituents like this one are often investigated for their potential use in targeted drug delivery systems, where enhanced stability and specificity are hugely beneficial.
  • Research Opportunities: The complexity of this molecule invites further research in terms of synthesis, optimization, and new applications, particularly in drug formulations that require high specificity and reduced side effects.

"In the world of chemistry, complexity often leads to ingenuity!" This quote resonates well with the ongoing exploration of this compound beyond its intrinsic characteristics, as scientists delve into the molecular mechanisms behind its actions and potential benefits.

The depth of 5-[acetyl(2,3-dihydroxypropyl)amino]-N3-(2,3-dihydroxypropyl)-N1-(2-hydroxyethyl)-2,4,6-triiodo-benzene-1,3-dicarboxamide serves as a reminder of the potential locked within chemical compounds, waiting to be discovered through persistent research and innovative thinking.

Synonyms
ioxilan
107793-72-6
Oxilan
Ioxitol
Ioxilane
Ioxilanum
Oxilan-300
Oxilan-350
Loxilan
UNII-A4YJ7J11TG
A4YJ7J11TG
NSC-760056
CCRIS 6727
DTXSID0048717
Ioxilane [INN-French]
Ioxilanum [INN-Latin]
5-[acetyl(2,3-dihydroxypropyl)amino]-3-N-(2,3-dihydroxypropyl)-1-N-(2-hydroxyethyl)-2,4,6-triiodobenzene-1,3-dicarboxamide
N-(2,3-Dihydroxypropyl)-5-(N-(2,3-dihydroxypropyl)acetamido)-N'-(2-hydroxyethyl)-2,4,6-triiodoisophthalamide
Ioxilan [USAN:USP:INN]
DTXCID7028643
NSC 760056
NCGC00182070-02
Ioxilane (INN-French)
Ioxilanum (INN-Latin)
IOXILAN (MART.)
IOXILAN [MART.]
IOXILAN (USP-RS)
IOXILAN [USP-RS]
Ioxilan (USAN:USP:INN)
1,3-Benzenedicarboxamide, 5-(acetyl(2,3-dihydroxypropyl)amino)-N-(2,3-dihydroxypropyl)-N'-(2-hydroxyethyl)-2,4,6-triiodo-
IOXILAN (USP IMPURITY)
IOXILAN [USP IMPURITY]
IOXILAN (USP MONOGRAPH)
IOXILAN [USP MONOGRAPH]
1,3-BENZENEDICARBOXAMIDE, 5-(ACETYL(2,3-DIHYDROXYPROPYL)AMINO)-N1-(2,3-DIHYDROXYPROPYL)-N3-(2-HYDROXYETHYL)-2,4,6-TRIIODO-
CAS-107793-72-6
Imagenil
1,3-Benzenedicarboxamide, 5-[acetyl(2,3-dihydroxypropyl)amino]-N1-(2,3-dihydroxypropyl)-N3-(2-hydroxyethyl)-2,4,6-triiodo-
N-(2,3-dihydroxypropyl)-N'-(2- hydroxyethyl)-5-(N-(2,3-dihydroxypropyl) acetamido)-2,4,6-triiodoisophthal-amide
N-(2,3-dihydroxypropyl)-N'-(2- hydroxyethyl)-5-[N-(2,3-dihydroxypropyl) acetamido]-2,4,6-triiodoisophthal-amide
Ioxilan (Standard)
Ioxilan(400 mg)
IOXILAN [VANDF]
LOXILAN [VANDF]
IOXILAN [USAN]
IOXILAN [INN]
IOXILAN [JAN]
IOXILAN [MI]
Oxilan-300 (TN)
IOXILAN [WHO-DD]
Ioxilan (JAN/USP/INN)
SCHEMBL25634
IOXILAN [ORANGE BOOK]
CHEMBL1201075
V08AB12
CHEBI:135884
HMS3264D15
MOLI000985
Pharmakon1600-01503838
Tox21_113127
EX-A10690
NSC760056
AKOS016014026
Tox21_113127_1
CCG-213210
DB09135
HY-109513R
NCGC00182070-03
5-(N-2,3-dihydroxypropylacetamido)-2,4,6-triiodo-N-(2-hydroxyethyl)-N'-(2,3-dihydroxypropyl)isophthalamide
DA-74509
MS-31454
HY-109513
CS-0031230
NS00007847
D02161
G12750
AB01563289_01
EN300-19767605
SR-01000883963
Q6064819
SR-01000883963-1
BRD-A09370961-001-01-0
5-(N-2,3-dihydroxypropylacetamido)-2,4,6-triiodo-N-(2-hydroxyethyl)-N -(2,3-dihydroxypropyl)-isophthalamide
N-(2,3-Dihdroxypropyl)-N -(2-hydroxyethyl)-5-[N-(2,3-dihydroxypropyl)acetamido]-2,4,6-triiodoiosphthalamide
N1-(2,3-dihydroxypropyl)-5-[N-(2,3-dihydroxypropyl)acetamido]-N3-(2-hydroxyethyl)-2,4,6-triiodobenzene-1,3-dicarboxamide