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Etodolac

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Identification
Molecular formula
C17H21NO3
CAS number
41340-25-4
IUPAC name
4,7-dibenzyl-5,6-dihydroxy-1,3-bis[[4-(hydroxymethyl)phenyl]methyl]-1,3-diazepan-2-one
State
State

At room temperature, Etodolac is a solid.

Melting point (Celsius)
145.00
Melting point (Kelvin)
418.20
Boiling point (Celsius)
422.20
Boiling point (Kelvin)
695.30
General information
Molecular weight
302.37g/mol
Molar mass
287.3690g/mol
Density
1.3341g/cm3
Appearence

Etodolac is a crystalline solid that is white to off-white in color.

Comment on solubility

Solubility of 4,7-dibenzyl-5,6-dihydroxy-1,3-bis[[4-(hydroxymethyl)phenyl]methyl]-1,3-diazepan-2-one

The solubility of the compound 4,7-dibenzyl-5,6-dihydroxy-1,3-bis[[4-(hydroxymethyl)phenyl]methyl]-1,3-diazepan-2-one (C17H21NO3) is an intriguing subject due to its complex structure. This compound presents a mix of hydrophobic and hydrophilic properties, influencing its solubility characteristics. Here are some key points to consider:

  • Hydrophilic Groups: The presence of hydroxyl (-OH) groups typically enhances solubility in polar solvents such as water.
  • Hydrophobic Aromatic Rings: The benzyl groups contribute to hydrophobic character, which can reduce solubility in aqueous environments.
  • Solvent Interaction: It can be anticipated that the solubility will be significantly greater in polar solvents, like ethanol or methanol, due to the capability of forming hydrogen bonds.
  • Concentration Effects: At higher concentrations, solubility may decrease due to intermolecular interactions among the hydrophobic components.

As a summary, the solubility of C17H21NO3 is a balance between its hydrophilic and hydrophobic characteristics, making it more soluble in polar solvents while potentially facing challenges in pure water. As one might say, “Like dissolves like,” and this compound is no exception as it will prefer environments that complement its unique chemical structure.

Interesting facts

Interesting Facts about 4,7-Dibenzyl-5,6-dihydroxy-1,3-bis[[4-(hydroxymethyl)phenyl]methyl]-1,3-diazepan-2-one

This fascinating compound is part of a class of chemicals known as diazepanes, which are characterized by their unique ring structure that incorporates both nitrogen and carbon atoms. Diazepanes have garnered interest in various fields, particularly in medicinal chemistry due to their potential therapeutic applications.

Chemical Structure and Attributes

  • Complexity: This compound features a multi-functional structure that includes multiple hydroxyl (-OH) groups, contributing to its reactivity and interaction with biological systems.
  • Diverse Substituents: The presence of benzyl and phenyl groups illustrates how substituents can significantly alter a compound’s properties, potentially enhancing its pharmacological benefits.
  • Potential Applications: Compounds like this one are often researched for their use in drug development, particularly in the creation of antitumoral agents or neuroprotective drugs.

Chemical Behavior

The multiple hydroxyl groups suggest strong hydrogen bonding capabilities, likely influencing the compound's solubility and interaction with other molecules. This also indicates potential for biological activity, as the hydrogen bonding can facilitate interaction with proteins or nucleic acids.

Research Opportunities

Given its intricate structure and interesting properties, 4,7-dibenzyl-5,6-dihydroxy-1,3-bis[[4-(hydroxymethyl)phenyl]methyl]-1,3-diazepan-2-one presents numerous research opportunities:

  • Investigating its biological activity and therapeutic potential.
  • Exploring synthesis methods to enhance yield and reduce costs.
  • Studying structure-activity relationships to optimize its use in pharmaceuticals.

In conclusion, this compound not only serves as a remarkable example of chemical intricacy but also symbolizes the broader possibilities within the realm of medicinal chemistry. Its unique characteristics make it a subject of study in the quest for developing new and effective therapeutic agents.

Synonyms
JCR 424; XM 323
4,7-dibenzyl-5,6-dihydroxy-1,3-bis[[4-(hydroxymethyl)phenyl]methyl]-1,3-diazepan-2-one
SCHEMBL8167058