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Lurasidone Hydrochloride

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Identification
Molecular formula
C28H36ClN5O2
CAS number
367514-88-3
IUPAC name
1-[3-(2-chlorobenzo[b][1]benzazepin-11-yl)propyl]-4-piperidin-1-ium-1-yl-piperidin-1-ium-4-carboxamide;4-hydroxy-4-oxo-but-2-enoate
State
State

At room temperature, Lurasidone Hydrochloride is in a solid state in the form of a powder. It is chemically stable under normal conditions but should be stored away from excessive heat and moisture to maintain its stability.

Melting point (Celsius)
235.00
Melting point (Kelvin)
508.15
Boiling point (Celsius)
463.20
Boiling point (Kelvin)
736.35
General information
Molecular weight
529.15g/mol
Molar mass
529.1480g/mol
Density
1.2470g/cm3
Appearence

Lurasidone Hydrochloride typically appears as a white to off-white powder. It does not have a distinct odor and presents itself as a crystalline solid, which is common for many pharmaceutical compounds.

Comment on solubility

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

The solubility of this compound is quite intriguing due to its complex structure. Generally, the solubility of a compound can be influenced by several factors, including:

  • Polarity: Compounds with polar functionalities tend to have better solubility in polar solvents. Given the ionic nature of the piperidin-1-ium groups, this compound may exhibit appreciable solubility in water.
  • Hydrogen Bonding: The presence of carboxamide and hydroxyl groups can facilitate strong hydrogen bonding, enhancing solubility in protic solvents such as methanol or ethanol.
  • Hydrophobic Regions: The chloro-substituted aromatic system could introduce hydrophobic characteristics. This can limit solubility in polar solvents but promote solubility in organic solvents such as chloroform or dimethyl sulfoxide.

Furthermore, one might say:

"Like dissolves like,"

indicating that similar polarities lead to improved solubility. Therefore, one could expect:

  • Good solubility in aqueous solutions, depending on pH.
  • Variable solubility in organic solvents influenced by the bulky aromatic rings.

Ultimately, the solubility profile of this compound is likely to be multifaceted, and empirical testing would provide the most accurate characterization.

Interesting facts

Interesting Facts about 1-[3-(2-chlorobenzo[b][1]benzazepin-11-yl)propyl]-4-piperidin-1-ium-1-yl-piperidin-1-ium-4-carboxamide; 4-hydroxy-4-oxo-but-2-enoate

This complex compound, often identified by its extensive name, illustrates the fascinating world of organic chemistry and the intricate relationships between molecular structure and biological activity. Here are some intriguing aspects to consider:

  • Multi-functional Moiety: The compound consists of multiple functional groups that contribute to its potential pharmacological properties. The presence of piperidine rings suggests possible interactions with neurotransmitter systems, particularly as piperidine derivatives are frequently explored in drug development.
  • Chlorobenzo[b][1]benzazepine Linkage: This structure implies potential use in psychiatric or neurological research, as benzazepines are known for their various effects on the central nervous system.
  • Versatile Derivative: The carboxamide function has been associated with increasing drug bioavailability, while the hydroxy-oxo component may enhance metabolic stability, making this compound a point of interest for medicinal chemists.
  • Visualizing Complexity: The lengthy and intricate nomenclature of the compound is a testament to the diverse avenues of synthesis and application in the chemical field. It serves as an example of how organic compounds can be meticulously designed to target specific biological pathways.

In the landscape of modern medicinal chemistry, compounds like this are crucial as they serve as leads for the development of new drugs. As one researcher noted, “Understanding the structural-activity relationship of such compounds is the key to innovation.”
By examining the molecular interactions at play, scientists can unlock new treatments for various conditions, showcasing the importance of compounds that may initially appear overwhelmingly complex.