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Identification
Molecular formula
C21H33N3O3
CAS number
478296-72-9
IUPAC name
1-cyclohexyl-5-pentyl-3-phenyl-hexahydropyrimidine-2,4,6-trione
State
State

At room temperature, the compound is in a solid state.

Melting point (Celsius)
159.10
Melting point (Kelvin)
432.25
Boiling point (Celsius)
271.80
Boiling point (Kelvin)
544.95
General information
Molecular weight
375.49g/mol
Molar mass
375.4930g/mol
Density
1.2000g/cm3
Appearence

The compound appears as a white crystalline powder.

Comment on solubility

Solubility of 1-cyclohexyl-5-pentyl-3-phenyl-hexahydropyrimidine-2,4,6-trione

The solubility of 1-cyclohexyl-5-pentyl-3-phenyl-hexahydropyrimidine-2,4,6-trione can be influenced by various factors that determine how it interacts with solvents. Understanding its solubility properties is crucial for applications in pharmaceuticals, as solubility affects bioavailability.

Key Aspects of Solubility:

  • Polarity: This compound embodies both hydrophobic (from the cyclohexyl and pentyl groups) and hydrophilic (from the trione functional groups) characteristics, which may lead to variable solubility in polar and non-polar solvents.
  • Temperature: Generally, an increase in temperature can enhance solubility for most compounds. However, the specific impact on this compound's solubility is not well-documented.
  • pH Levels: The ionization state of the trione groups may change with pH, potentially affecting solubility in aqueous solutions.
  • Solvent Choice: Compatibility with solvents is essential, and solvents like DMSO or ethanol might enhance the solubility compared to water.

In essence, the solubility of 1-cyclohexyl-5-pentyl-3-phenyl-hexahydropyrimidine-2,4,6-trione remains a complex interplay of molecular structure and environmental factors. As expressed in the saying, "Like dissolves like," understanding this principle can help predict its behavior in various solvent systems.

Interesting facts

Interesting Facts about 1-cyclohexyl-5-pentyl-3-phenyl-hexahydropyrimidine-2,4,6-trione

This compound, a derivative of hexahydropyrimidine, exhibits fascinating structural characteristics that contribute to its potential applications in various fields of research. Here are some key insights:

  • Structural Diversity: The compound features a unique arrangement of cyclohexyl and pentyl groups alongside a phenyl ring. This diversity in its structure can lead to distinct chemical behavior and biological activity.
  • Potential Biological Activity: As a trione, this compound may possess intriguing interactions with biological systems. Compounds with similar structures have been studied for their potential in medicinal chemistry, especially in the context of anti-inflammatory and antimicrobial properties.
  • Research Relevance: The hexahydropyrimidine core is of considerable interest in the field of organic synthesis. Understanding how to manipulate this structure can lead to advancements in drug design and development.
  • Pharmaceutical Applications: The unique combination of aliphatic and aromatic systems suggests that this compound could serve as a versatile scaffold for synthesizing new pharmaceuticals, particularly in the treatment of neurological and metabolic disorders.
  • Ligand Design: The presence of the cyclohexyl and pentyl side chains may enable this compound to act as a ligand in coordination chemistry, potentially forming complexes with transition metals and influencing their reactivity.

In summary, the complexities of 1-cyclohexyl-5-pentyl-3-phenyl-hexahydropyrimidine-2,4,6-trione open avenues for various scientific investigations spanning from synthesis to application. Its structural components not only enhance its chemical profile but also spark curiosity among chemists eager to explore new compounds in drug discovery.

Synonyms
1-Cyclohexyl-5-pentyl-3-phenylbarbituric acid
1051-12-3
1-cyclohexyl-5-pentyl-3-phenyl-1,3-diazinane-2,4,6-trione
BRN 0765496
BARBITURIC ACID, 1-CYCLOHEXYL-5-PENTYL-3-PHENYL-
1-Cyclohexyl-5-pentyl-3-phenyl-2,4,6(1H,3H,5H)-pyrimidinetrione
DTXSID30909330