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Benzazepin derivative

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Identification
Molecular formula
C21H28N2O2
CAS number
110221-44-2
IUPAC name
1-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-2-[4-(2-hydroxyethyl)piperazin-1-yl]ethanone
State
State

The compound is typically a solid at room temperature, with a high melting point indicating significant stability in the solid phase. Its crystalline nature can influence how it is handled in laboratory settings.

Melting point (Celsius)
180.00
Melting point (Kelvin)
453.00
Boiling point (Celsius)
300.00
Boiling point (Kelvin)
573.00
General information
Molecular weight
364.49g/mol
Molar mass
364.4850g/mol
Density
1.2000g/cm3
Appearence

This compound appears as a crystalline solid, often characterized by its distinct structural features of both a benzazepine and a piperazine ring system. It may vary in color from white to off-white or pale yellow, depending on purity and the presence of potential impurities.

Comment on solubility

Solubility of 1-(5,6-dihydrobenzob[1]benzazepin-11-yl)-2-[4-(2-hydroxyethyl)piperazin-1-yl]ethanone

The compound 1-(5,6-dihydrobenzob[1]benzazepin-11-yl)-2-[4-(2-hydroxyethyl)piperazin-1-yl]ethanone presents intriguing solubility characteristics due to its complex structure. The presence of various functional groups plays a crucial role in determining its solubility profile.

Factors Influencing Solubility:

  • Polar vs. Nonpolar: The compound exhibits both polar and nonpolar regions. The 2-hydroxyethyl group contributes to its polarity, potentially enhancing solubility in polar solvents like water.
  • Hydrogen Bonding: The hydroxy group can engage in hydrogen bonding, which often increases solubility in aqueous solutions.
  • Alkyl Chain Length: The length of the piperazine moiety may impact the overall hydrophobicity, influencing how well the compound dissolves.

In general, it is likely that this compound is:

  • Soluble in: Polar solvents such as water and alcohols, owing to its hydrophilic characteristics.
  • Slightly soluble or insoluble in: Nonpolar solvents, as the nonpolar aspects of the structure may resist solvation.

In conclusion, the solubility of this compound is expected to vary significantly depending on the solvent used, making it essential to understand the specific solvent interactions and conditions to accurately predict solubility behavior.

Interesting facts

Interesting Facts about 1-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-2-[4-(2-hydroxyethyl)piperazin-1-yl]ethanone

This complex organic compound, known for its intricate molecular structure, is a fascinating subject for both chemists and pharmacologists. It is particularly notable for its potential applications in medicinal chemistry. Here are some key facts:

  • Pharmaceutical Relevance: Compounds similar to this structure are often investigated for their pharmacological activities, including potential antidepressant and anxiolytic effects.
  • Structural Complexity: The presence of both dihydrobenzo and piperazine moieties suggests a multi-functional profile, which facilitates various interactions in biological systems.
  • Therapeutic Targets: This compound could be of interest in research targeting neurotransmitter pathways, especially those related to serotonin and dopamine.
  • Heterocyclic Chemistry: The incorporation of heterocyclic rings in its structure provides opportunities for exploring new chemical reactivity and synthesis methodologies.
  • Integration of Hydroxyethyl: The hydroxyethyl substituent plays a crucial role in enhancing water solubility and potentially modulating the compound's pharmacokinetic properties.

The exploration of such compounds within medicinal chemistry not only enriches our understanding of complex biological systems but also aids in the discovery of novel therapeutics. A quotation that resonates with many in the field is, “Chemistry is the mother of all sciences,” emphasizing the foundational role that compounds like this play in advancing human health.

As research continues, compounds with unique structures and properties like this one remind us of the endless possibilities within the realm of chemistry.