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Loperamide oxalate

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Identification
Molecular formula
C29H34ClN3O3 · C4H6O5
CAS number
34552-83-5
IUPAC name
[4-carbamoyl-1-[3-(3-chlorobenzo[b][1]benzazepin-11-yl)propyl]piperidin-1-ium-4-yl]-dimethyl-ammonium;4-hydroxy-4-oxo-but-2-enoate
State
State
At room temperature, loperamide oxalate is in solid state.
Melting point (Celsius)
228.00
Melting point (Kelvin)
501.15
Boiling point (Celsius)
354.00
Boiling point (Kelvin)
627.15
General information
Molecular weight
663.52g/mol
Molar mass
663.5170g/mol
Density
0.3674g/cm3
Appearence

Loperamide oxalate appears as a white to off-white crystalline powder.

Comment on solubility

Solubility of [4-carbamoyl-1-[3-(3-chlorobenzo[b][1]benzazepin-11-yl)propyl]piperidin-1-ium-4-yl]-dimethyl-ammonium;4-hydroxy-4-oxo-but-2-enoate

The solubility of this complex compound can be quite intricate due to its polyfunctional nature and the various moieties present in the structure. Generally, the solubility of a compound is influenced by several factors:

  • Polarity: The presence of multiple polar functional groups often increases solubility in polar solvents such as water.
  • Hydrogen Bonding: Compounds capable of forming hydrogen bonds tend to be more soluble. This compound, with its ammonium and carbonyl groups, may exhibit significant hydrogen bonding interactions.
  • Size and Sterics: The bulky aromatic structures can hinder solubility due to steric factors, leading to reduced interaction with solvent molecules.
  • pH Effects: Given that the compound contains an ammonium moiety, changes in pH can impact its ionization and, subsequently, its solubility profiles.

In conclusion, while the solubility is likely to be higher in polar solvents due to ionic interactions and hydrogen bonding, the precise solubility characteristics would need to be evaluated through experimental measures. As a general rule, "the *like dissolves like* principle" applies, meaning that this compound will have greater solubility in solvents that share similar polarity properties.

Interesting facts

Exploring 4-carbamoyl-1-[3-(3-chlorobenzo[b][1]benzazepin-11-yl)propyl]piperidin-1-ium-4-yl]-dimethyl-ammonium;4-hydroxy-4-oxo-but-2-enoate

This fascinating compound is a rich tapestry of chemical interactions and pharmaceutical potential. It uniquely combines a piperidine structure with a benzazepine moiety, suggesting a potential for notable biological activity. Here are some intriguing aspects to consider:

  • Multi-functional Roles: With its distinct structure, it may exhibit diverse pharmacological properties. Compounds like this often serve in the design of new medications that target various biochemical pathways.
  • Chlorobenzo[b][1]benzazepine Component: The presence of the chlorobenzo[b][1]benzazepine substructure is particularly interesting, as this class of compounds has been researched for their potential in treating neurological disorders and other medical conditions.
  • Diverse Applications: Due to its unique structural features, it could contribute to:
    • Neuropharmacology
    • Antidepressant development
    • Antipsychotic research
  • Potential Synthesis Challenges: The complexity of its structure suggests that synthesizing this compound could present challenges, making it a compelling subject for advanced organic chemistry studies.
  • Importance of Carbamoyl Group: The carbamoyl group attached to the piperidine plays a crucial role in the compound's reactivity and biological activity, affecting its interaction with target sites in a biological system.

As scientists delve deeper into the characterization and applications of such compounds, we can anticipate exciting developments in medicinal chemistry. The intricacies of their structures often yield surprises, revealing mechanisms and therapeutic benefits that are yet to be fully understood.

"Chemistry is like the universe, infinite and full of potential waiting to be discovered."