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Clomethiazole

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Identification
Molecular formula
C12H13ClN2O2
CAS number
533-45-9
IUPAC name
5-(3-chlorophenyl)-5-ethyl-hexahydropyrimidine-2,4,6-trione
State
State

At room temperature, Clomethiazole is typically found in a solid state.

Melting point (Celsius)
114.00
Melting point (Kelvin)
387.15
Boiling point (Celsius)
385.00
Boiling point (Kelvin)
658.15
General information
Molecular weight
250.69g/mol
Molar mass
250.6850g/mol
Density
1.3130g/cm3
Appearence

Clomethiazole typically appears as a white or off-white crystalline powder. It may also come in solid form characterized by its fine crystalline structure.

Comment on solubility

Solubility of 5-(3-chlorophenyl)-5-ethyl-hexahydropyrimidine-2,4,6-trione

The solubility of 5-(3-chlorophenyl)-5-ethyl-hexahydropyrimidine-2,4,6-trione is influenced by several factors, primarily its chemical structure and interactions with solvents. Here are some key points regarding its solubility:

  • Polarity: The presence of the 3-chlorophenyl and ethyl groups affects the overall polarity of the molecule, which in turn impacts its solubility in various solvents.
  • Solvent Type: This compound is likely to dissolve well in polar organic solvents such as ethanol and dimethyl sulfoxide (DMSO) due to its functional groups.
  • Water Solubility: Given its structure, it may exhibit limited solubility in water. This is typical for many organic compounds that are not highly polar or ionic.
  • Temperature Influence: As with many chemical compounds, increasing the temperature can enhance solubility. This effect is particularly notable in organic solvents.

In summary, the solubility of 5-(3-chlorophenyl)-5-ethyl-hexahydropyrimidine-2,4,6-trione can be summarized as follows:

  • Good solubility in polar organic solvents
  • Poor to moderate solubility in water
  • Affected by temperature and solvent interactions

Understanding the solubility of this compound is essential for its applications in synthesis, formulation, and other chemical processes.

Interesting facts

Interesting Facts about 5-(3-chlorophenyl)-5-ethyl-hexahydropyrimidine-2,4,6-trione

This compound, known for its complex structure and biological significance, belongs to a class of compounds called pyrimidines. Pyrimidines are pivotal in various biological processes, playing a crucial role in the structure of nucleotides, which are the building blocks of DNA and RNA. The unique configuration of 5-(3-chlorophenyl)-5-ethyl-hexahydropyrimidine-2,4,6-trione includes a chlorophenyl group, which imparts specific electronic and steric properties that can influence its reactivity and interaction with biological targets.

Key Features:

  • Pharmacological Potential: Compounds with heterocyclic structures like this one are often investigated for their therapeutic potential, including their action against various diseases.
  • Synthetic Versatility: The synthesis of pyrimidine derivatives is a well-studied area in organic chemistry, allowing chemists to modify the compound for enhanced pharmacological properties.
  • Research Applications: The presence of the ethyl group may enhance lipophilicity, making it a candidate for drug development and molecular biology studies.
  • Structure-Activity Relationships: Understanding how the chlorine substitution on the phenyl group affects biological activity can lead to valuable insights in medicinal chemistry.

As scientists delve into the complexities of this compound, it offers a fascinating glimpse into the world of organic synthesis and pharmaceutical chemistry. Continued research could uncover new applications, further emphasizing the importance of structural variations in drug design.


Synonyms
BRN 0268308
BARBITURIC ACID, 5-(m-CHLOROPHENYL)-5-ETHYL-
5-(m-Chlorophenyl)-5-ethyl-barbituric acid
379-32-8
Acido 5-(m-clorofenil)-5-etilbarbiturico [Italian]
Acido 5-(m-clorofenil)-5-etilbarbiturico
DTXSID00191326
DTXCID10113817