5-allyl-2-sulfanyl-5-tetradecyl-1H-pyrimidine-4,6-dione

Identification

Molecular formula

C₂₄H₄₀N₂O₂S

CAS number

34589-59-2

IUPAC name

5-allyl-2-sulfanyl-5-tetradecyl-1H-pyrimidine-4,6-dione

State

At room temperature, this compound is typically found as a solid. Due to its large hydrocarbon chain, it may be waxy in nature, adding to the solid state characteristics. It is generally stable under standard conditions.

Melting point (Celsius)

64.10

Melting point (Kelvin)

337.30

Boiling point (Celsius)

544.40

Boiling point (Kelvin)

817.60

General information

Molecular weight

396.64g/mol

Molar mass

396.6440g/mol

Density

0.9887g/cm³

Appearence

The compound 5-allyl-2-sulfanyl-5-tetradecyl-1H-pyrimidine-4,6-dione typically appears as a crystalline solid. The exact color and crystalline structure might vary, but such compounds are often white to off-white. The crystalline appearance might exhibit some luster depending on the purity and crystalline form.

Comment on solubility

Solubility Overview

The solubility of 5-allyl-2-sulfanyl-5-tetradecyl-1H-pyrimidine-4,6-dione can be nuanced given its unique chemical structure. Generally, the solubility of such compounds is influenced by several factors including:

Polarity: The presence of the sulfanyl group can create polar characteristics, making it more soluble in polar solvents.
Hydrocarbon Chain: The long tetradecyl chain introduces hydrophobic properties, which may limit solubility in water but enhance solubility in organic solvents.
Functional Groups: The dione functionality can facilitate interactions with solvents, potentially increasing solubility under specific conditions.

When evaluating solubility, it’s essential to consider:

Temperature: Solubility often increases with temperature.
pH Levels: Changes in pH can affect ionization and thus influence solubility.
Presence of Co-solvents: They can modify solubility characteristics significantly.

In conclusion, while 5-allyl-2-sulfanyl-5-tetradecyl-1H-pyrimidine-4,6-dione has potential solubility in various organic solvents due to its hydrophobic and polar sites, comprehensive solubility data may be necessary for specific applications. As with many compounds, the phrase "solubility is life!" rings profoundly true, as understanding solubility can determine both functionality and usability of a chemical in practical scenarios.

Interesting facts

Interesting Facts about 5-Allyl-2-sulfanyl-5-tetradecyl-1H-pyrimidine-4,6-dione

This unique compound, known as 5-allyl-2-sulfanyl-5-tetradecyl-1H-pyrimidine-4,6-dione, showcases the fascinating possibilities of organic chemistry and the versatility of pyrimidine derivatives. Here are some striking facts about this compound:

Pyrimidine Insights: Pyrimidine is a basic building block in biochemistry, forming structural components of nucleic acids (DNA and RNA). This highlights the significance of the pyrimidine moiety in biological processes.
Functional Groups: The presence of both the allyl group and the sulfanyl group in this compound enhances its pharmacological properties, possibly contributing to its biological activities. Such modifications can influence solubility, reactivity, and molecular interactions.
Structure-Activity Relationship: The integration of a long-chain alkyl group (tetradecyl) offers a hydrophobic character, which may enhance lipid solubility. This characteristic is crucial when investigating drug delivery systems and the bioavailability of pharmaceutical compounds.
Potential Applications: Compounds like this have potential applications in various fields, including:
- Medicinal chemistry, where they may serve as candidates for therapeutic agents.
- Agricultural chemistry, where similar compounds have shown efficacy as pesticides or herbicides.
- Materials science, for developing novel materials with specific properties.
Chemical Synthesis: The synthesis of such compounds often requires sophisticated techniques in organic chemistry, such as multi-step reactions and careful control of reaction conditions to ensure desired yields and purities.

In conclusion, the compound 5-allyl-2-sulfanyl-5-tetradecyl-1H-pyrimidine-4,6-dione stands as an intriguing entity within the realm of chemical research. Its unique combination of structural features and potential applications make it worthy of further exploration. As one scientist aptly put it, "Understanding the intricacies of chemical compounds opens doors to countless possibilities in innovation and discovery."