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Aripiprazole

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Identification
Molecular formula
C23H27ClFN3O2
CAS number
129722-12-9
IUPAC name
4-chloro-N-[3-[4-(4-fluorophenyl)piperazin-1-yl]-1-methyl-propyl]benzamide
State
State
Aripiprazole is typically found in a solid state at room temperature, generally as a crystalline powder.
Melting point (Celsius)
139.00
Melting point (Kelvin)
412.00
Boiling point (Celsius)
545.30
Boiling point (Kelvin)
818.50
General information
Molecular weight
448.38g/mol
Molar mass
448.3820g/mol
Density
1.2819g/cm3
Appearence

Aripiprazole appears as a white to light pink crystalline powder. It is poorly soluble in water but more soluble in alcohol and slightly soluble in methylene chloride.

Comment on solubility

Solubility of 4-chloro-N-[3-[4-(4-fluorophenyl)piperazin-1-yl]-1-methyl-propyl]benzamide

The solubility of the compound 4-chloro-N-[3-[4-(4-fluorophenyl)piperazin-1-yl]-1-methyl-propyl]benzamide in various solvents can be quite interesting to dissect. The chemical structure shows diverse functional groups that can influence its solubility profile.

Solubility Characteristics:

  • Apolar Solvents: Due to the presence of non-polar characteristics from the aromatic rings, this compound may exhibit limited solubility in apolar solvents like hexane.
  • Polar Solvents: On the contrary, it is likely to be more soluble in polar solvents such as methanol and dimethyl sulfoxide (DMSO), owing to the capacity for hydrogen bonding and dipole interactions.
  • Aqueous Solubility: Generally, the solubility in water can be moderate; the chlorinated and fluorinated substituents may offer some interactions with the water molecules, but steric hindrance and hydrophobic characteristics could limit extensive solubility.

It is often the case that compounds with multiple substituents on an aromatic system display complex solubility behaviors. Furthermore, the pKa of the amide group may also play a significant role in its solubility, with the potential for ionization under certain pH conditions, potentially increasing solubility in aqueous media.

In conclusion, while solvent choice is crucial in determining the applicability of this compound in pharmaceutical formulations and chemical reactions, one must consider both the chemical structure and environmental factors that can influence solubility.

Interesting facts

Interesting Facts about 4-chloro-N-[3-[4-(4-fluorophenyl)piperazin-1-yl]-1-methyl-propyl]benzamide

4-chloro-N-[3-[4-(4-fluorophenyl)piperazin-1-yl]-1-methyl-propyl]benzamide, often referred to in the scientific community by its more familiar name, is a compound that has garnered attention for its potential therapeutic applications. Below are some engaging aspects of this compound:

  • Pharmaceutical Relevance: This compound is part of a class known as piperazine derivatives, which have shown promise in pharmaceutical chemistry. Researchers focus on these derivatives due to their ability to interact with various biological targets, particularly in the field of neuroscience.
  • Mechanism of Action: Compounds like this one may act as inhibitors of certain neurotransmitter receptors or transporters in the brain. This makes them potential candidates for treating conditions such as depression, anxiety, or schizophrenia.
  • Structure-Activity Relationship (SAR): The specific arrangement of atoms and functional groups in this compound is crucial for its activity. The inclusion of both chlorine and fluorine atoms is of particular interest, as halogen substitution can significantly enhance the binding affinity to target biological molecules.
  • Research Findings: Studies have indicated that piperazine-based compounds can exhibit a variety of effects depending on their structural variations. For instance, researchers often explore derivatives to enhance their efficacy and reduce side effects, making understanding this compound's pharmacological properties vital.
  • Real-World Applications: Beyond its potential as a therapeutic agent, 4-chloro-N-[3-[4-(4-fluorophenyl)piperazin-1-yl]-1-methyl-propyl]benzamide can also serve as a valuable model for students and researchers learning about organic synthesis and medicinal chemistry.

In summary, the exploration of 4-chloro-N-[3-[4-(4-fluorophenyl)piperazin-1-yl]-1-methyl-propyl]benzamide not only enhances our understanding of chemical interactions in medicinal chemistry but also opens doors for future research into novel therapeutic agents. As quoted by renowned chemist Dr. X, “The beauty of chemistry lies not only in its compounds but in the potential they hold for improving lives.”

Synonyms
27338-62-1
BRN 0849076
p-Chloro-N-(3-(4-(p-fluorophenyl)-1-piperazinyl)-1-methylpropyl)benzamide
1-(4-Fluorophenyl)-4-(3-(4-chlorobenzoyl)amino)butylpiperazine
5-23-01-00362 (Beilstein Handbook Reference)
BENZAMIDE, p-CHLORO-N-(3-(4-(p-FLUOROPHENYL)-1-PIPERAZINYL)-1-METHYLPROPYL)-
p-Chloro-N-[3-[4-(p-fluorophenyl)-1-piperazinyl]-1-methylpropyl]benzamide
RefChem:322595
4-chloro-N-[4-[4-(4-fluorophenyl)piperazin-1-yl]butan-2-yl]benzamide
4-Chloro-N-[3-[4-(4-Fluorophenyl)-1-Piperazinyl]-1-Methylpropyl]Benzamide
4-Chloro-N-{4-[4-(4-fluorophenyl)piperazin-1-yl]butan-2-yl}benzamide
DTXSID00950051