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Clobenzorex

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Identification
Molecular formula
C18H22ClN3O2S
CAS number
13364-32-4
IUPAC name
2-[(5-chloro-1,3-benzoxazol-2-yl)sulfanyl]-N,N-diethyl-ethanamine
State
State
At room temperature, Clobenzorex exists as a solid. It is typically handled in powdered form for ease of use in various chemical and pharmaceutical applications.
Melting point (Celsius)
167.00
Melting point (Kelvin)
440.15
Boiling point (Celsius)
420.40
Boiling point (Kelvin)
693.55
General information
Molecular weight
300.82g/mol
Molar mass
300.8200g/mol
Density
1.2600g/cm3
Appearence

Clobenzorex typically appears as a white crystalline powder. It does not have any distinct color and may appear either as a fine powder or in crystalline form depending on its state of preparation and purity.

Comment on solubility

Solubility of 2-[(5-chloro-1,3-benzoxazol-2-yl)sulfanyl]-N,N-diethyl-ethanamine

The solubility of 2-[(5-chloro-1,3-benzoxazol-2-yl)sulfanyl]-N,N-diethyl-ethanamine can exhibit interesting characteristics due to its unique structure. Here are some important aspects to consider:

  • Polarity: This compound features both polar and nonpolar functional groups, making its solubility a balance between hydrophilicity and lipophilicity. The presence of the benzoxazole ring contributes to its overall hydrophobic nature, while the ethylamine groups increase its potential water solubility.
  • Solvent Compatibility: 2-[(5-chloro-1,3-benzoxazol-2-yl)sulfanyl]-N,N-diethyl-ethanamine is likely to dissolve well in organic solvents, such as:
    • Ethyl acetate
    • Ethanol
    • Dichloromethane
    However, its solubility in water may be limited, reflecting a characteristic trend seen with similar compounds.
  • Temperature Effects: As with many organic compounds, solubility may increase with temperature. It may demonstrate enhanced solubility when heated, allowing for easier manipulation in laboratory settings.
  • pH Dependency: Changes in pH can affect the ionization state of the amine, potentially altering its solubility in an aqueous medium. In more alkaline conditions, increased solubility can often be observed due to deprotonation.

In summary, while this compound may display limited water solubility, it is anticipated to have good solubility in a variety of organic solvents. Understanding and predicting the solubility behavior of 2-[(5-chloro-1,3-benzoxazol-2-yl)sulfanyl]-N,N-diethyl-ethanamine is vital for its practical applications in synthetic and pharmacological contexts.

Interesting facts

Exploring 2-[(5-chloro-1,3-benzoxazol-2-yl)sulfanyl]-N,N-diethyl-ethanamine

This compound, known for its intriguing molecular structure and notable properties, falls under the category of sulfanyl derivatives, which are significant in various fields of chemistry and medicinal research. Here are some fascinating aspects of this compound:

  • Pharmacological Potential: Compounds like 2-[(5-chloro-1,3-benzoxazol-2-yl)sulfanyl]-N,N-diethyl-ethanamine possess various biological activities, making them subjects of interest in drug discovery. Research has suggested that similar compounds may exhibit antimicrobial and anticancer properties.
  • Sulfur in Chemistry: The presence of a sulfur atom in its structure is noteworthy. Sulfur’s unique properties, such as its ability to form diverse bonds, make sulfur-containing compounds pivotal in organic synthesis and biochemical processes.
  • Chlorine's Role: The chloro group (5-chloro) is essential for enhancing the biological activity of the compound. Halogenated compounds are often more reactive and can lead to increased affinity for biological targets.
  • Versatile Applications: This compound's structure opens up avenues for application in material science and agrochemicals, addressing challenges ranging from crop protection to the development of new materials.
  • Complex Synthesis: The synthesis of such compounds often involves intricate synthetic pathways, showcasing the ingenuity required in organic chemistry. Understanding these pathways is crucial for scientists looking to create novel compounds with tailored properties.

In summary, 2-[(5-chloro-1,3-benzoxazol-2-yl)sulfanyl]-N,N-diethyl-ethanamine embodies the intersection of chemistry and biology, where structural intricacies yield significant potential for innovations in healthcare, agriculture, and beyond. As researchers continue to explore its attributes, this compound stands as a testament to the ongoing quest for understanding and utilizing complex chemical entities.