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4-3c1,3-benzodioxol-5-ylmethyl3e-1-5c[4-benzyl-2-hydroxy-5-5c3b5c5c5c(2-hydroxyindan-1-yl3eamino3d5c5c5d5c3b5c5c5d5c5fN-tert-butyl-piperazine-2-carboxamide

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Identification
Molecular formula
C33H41N3O5
CAS number
NA
IUPAC name
4-(1,3-benzodioxol-5-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, this compound typically exists in a solid state, which may vary between amorphous and crystalline forms depending on specific synthetic conditions and its degree of purity.

Melting point (Celsius)
0.00
Melting point (Kelvin)
0.00
Boiling point (Celsius)
0.00
Boiling point (Kelvin)
0.00
General information
Molecular weight
555.67g/mol
Molar mass
555.6700g/mol
Density
1.2000g/cm3
Appearence

This compound is typically a solid at room temperature, appearing as a fine to off-white powder. It may be crystalline or amorphous depending on its production method.

Comment on solubility

Solubility of 4-(1,3-benzodioxol-5-ylmethyl)-1-[4-benzyl-2-hydroxy-5-[(2-hydroxyindan-1-yl)amino]-5-oxo-pentyl]-N-tert-butyl-piperazine-2-carboxamide

The solubility characteristics of the compound with the chemical formula C33H41N3O5 are particularly intriguing, given its complex structure and the presence of various functional groups.

Factors Influencing Solubility

Several factors can influence the solubility of this compound, including:

  • Polarity: The presence of hydroxyl (–OH) groups typically increases solubility in polar solvents.
  • Hydrogen Bonding: The ability of hydroxyl groups to form hydrogen bonds can enhance interaction with solvent molecules.
  • Molecular Size: The relatively large and complex structure may hinder solubility in some solvents, especially those with lower dielectric constants.
  • Ionization: The carboxamide functional group may affect solubility depending on pH and potential ionization.

Expected Solubility

Given the intricate balance of hydrophilic and hydrophobic segments within its structure, the solubility of this compound is likely to exhibit:

  • High solubility in polar solvents such as ethanol or methanol due to the presence of hydroxyl groups.
  • Lower solubility in non-polar solvents like hexane, attributed to the extensive hydrophobic regions present.

In conclusion, while the solubility can vary significantly based on the solvent and conditions, it is reasonable to anticipate a preferred solubility profile in polar environments, complemented by the structural features of this complex molecule.

Interesting facts

Interesting Facts about 4-(1,3-benzodioxol-5-ylmethyl)-1-[4-benzyl-2-hydroxy-5-[(2-hydroxyindan-1-yl)amino]-5-oxo-pentyl]-N-tert-butyl-piperazine-2-carboxamide

This compound, with its intricate structure, belongs to a class of compounds known for their potential pharmacological properties. Here are some fascinating aspects:

  • Complex Structure: The compound consists of multiple functional groups, which may contribute to its unique biological activity. It includes a piperazine ring, which is commonly found in many pharmaceuticals, enhancing its pharmacological profile.
  • Bioactivity: Compounds similar to this one have been studied for various activities such as anti-inflammatory, analgesic, and even potential neuroprotective properties. Researchers often investigate these compounds for their therapeutic implications.
  • Drug Design: The multi-functional nature of this molecule makes it an interesting candidate for drug design. The presence of both hydrophobic and hydrophilic components helps it to interact with different biological targets effectively.
  • Natural Inspirations: The compound features fragments that are reminiscent of natural products, indicating a possible avenue for synthesizing novel derivatives that mimic biologically active natural compounds.

In the realm of chemistry, this compound exemplifies the complexity that can arise in drug molecules, often requiring intricate synthesis methods to produce. This complexity is desirable because it allows researchers to explore various interactions within biological systems. As chemists delve deeper into the analysis of such compounds, they pave the way for discoveries that could lead to significant advancements in medicine.