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Identification
Molecular formula
C40H44N2O4
CAS number
N/A
IUPAC name
4-(benzofuran-2-ylmethyl)-1-[4-benzyl-2-hydroxy-5-[(2-hydroxyindan-1-yl)amino]-5-oxo-pentyl]-N-tert-butyl-piperazine-2-carboxamide
State
State

At room temperature, it is typically in a solid state. The material is generally stable under normal conditions, but needs to be stored in a cool, dry place to maintain its stability and prevent degradation.

Melting point (Celsius)
198.40
Melting point (Kelvin)
471.55
Boiling point (Celsius)
745.50
Boiling point (Kelvin)
1 018.65
General information
Molecular weight
664.82g/mol
Molar mass
664.8230g/mol
Density
1.3200g/cm3
Appearence

The compound is typically a crystalline solid with a fine, powdery texture. It may also appear as a colorless or off-white substance, depending on its purity and the presence of impurities.

Comment on solubility

Solubility of 4-(benzofuran-2-ylmethyl)-1-[4-benzyl-2-hydroxy-5-[(2-hydroxyindan-1-yl)amino]-5-oxo-pentyl]-N-tert-butyl-piperazine-2-carboxamide

The solubility of the compound C40H44N2O4 is an intriguing topic due to its complex structure and interactions. Understanding its solubility can be crucial for various applications, especially in drug formulation and chemical synthesis.

Generally, the solubility of a compound can be influenced by several factors:

  • Polarity: The presence of polar functional groups, such as hydroxyl (-OH) and amine (-NH2), can enhance water solubility.
  • Molecular Size: Larger molecules may exhibit lower solubility due to steric hindrance.
  • Hydrogen Bonding: The ability of a compound to form hydrogen bonds can significantly increase solubility, especially in polar solvents.
  • Temperature: Increasing temperature often enhances solubility for solid compounds.

For C40H44N2O4, the solubility can be characterized as follows:

  • The presence of multiple hydroxyl groups suggests a potential for significant solubility in polar solvents.
  • However, the large hydrophobic aromatic portions may hinder solubility in purely aqueous environments.
  • "The balance between hydrophilic and hydrophobic characteristics is key."

In summary, while the complex structure contains factors conducive to solubility, one might expect moderate solubility in water and better solubility in mixed solvents or organic solvents, depending on the conditions applied. It is always advisable to conduct empirical tests to determine the precise solubility behavior of compounds like this one.

Interesting facts

Interesting Facts about 4-(benzofuran-2-ylmethyl)-1-[4-benzyl-2-hydroxy-5-[(2-hydroxyindan-1-yl)amino]-5-oxo-pentyl]-N-tert-butyl-piperazine-2-carboxamide

This complex compound belongs to the realm of medicinal chemistry, illustrating the fascinating relationship between structure and biological activity. Its intricate structure comprises various functional groups that make it particularly noteworthy:

  • Benzofuran moiety: The presence of benzofuran suggests potential antioxidant properties, as compounds featuring this feature are often investigated for their ability to combat oxidative stress.
  • Piperazine ring: This 6-membered nitrogen-containing ring is frequently found in pharmaceuticals, enhancing the compound's pharmacokinetic profile.
  • Hydroxy and amino groups: These functional groups can significantly influence biochemical interactions, providing sites for hydrogen bonding, which can enhance solubility and affinity for biological targets.

Moreover, the compound exhibits the ability to cross biological membranes, posing a promising avenue for various therapeutic applications. One enticing possibility is its potential use as a pharmacological agent, given that many compounds with similar frameworks have shown activity against various diseases.

As Dr. David K. Jones once said, "The complexity of synthetic compounds is where the beauty of chemistry lies." This compound exemplifies that beauty, showcasing the art of molecular design that scientists employ to develop therapies for complex health issues.

In addition to its therapeutic potential, synthesizing such a compound can provide valuable insights into reaction pathways and the optimization of molecular interactions, making it a prime candidate for further research and development in the field of organic chemistry.