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6-Chloro-3-{2-[(4-pyridinyl)methyl]ethyl}benzo[e][1,3]oxazin-2(3H)-one

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Identification
Molecular formula
C14H13ClN2O
CAS number
139162-65-9
IUPAC name
6-chloro-3-[2-(4-pyridyl)ethyl]-1,4-dihydro-2,3-benzoxazine
State
State

At room temperature, the compound is in a solid state. Its stability and physical state are preferred for storage and handling under typical room conditions, avoiding moisture and direct sunlight.

Melting point (Celsius)
212.00
Melting point (Kelvin)
485.15
Boiling point (Celsius)
472.00
Boiling point (Kelvin)
745.15
General information
Molecular weight
262.72g/mol
Molar mass
262.7150g/mol
Density
1.2930g/cm3
Appearence

The compound predominantly appears as a solid at room temperature. It is typically presented in crystalline form, characterized by its fine, solid particles. The color can range from off-white to a pale yellow hue.

Comment on solubility

Solubility of 6-chloro-3-[2-(4-pyridyl)ethyl]-1,4-dihydro-2,3-benzoxazine

The solubility of 6-chloro-3-[2-(4-pyridyl)ethyl]-1,4-dihydro-2,3-benzoxazine can be influenced by various factors such as temperature, pH, and the presence of solvents. This compound, featuring both a pyridine and benzoxazine moiety, presents a unique behavior in different media:

  • Polar solvents: Generally, compounds with nitrogen-containing heterocycles tend to have better solubility in polar solvents due to dipole interactions. Therefore, it may exhibit moderate solubility in water and alcohols.
  • Non-polar solvents: Its aromatic structure may lead to increased solubility in non-polar organic solvents, such as hexane or toluene, as a result of hydrophobic interactions.
  • Temperature effects: Like many organic compounds, solubility may increase with temperature. Thus, a higher temperature may improve solubility in both categories of solvents.

It's relevant to note that the solubility of this compound in aqueous solutions may vary dramatically with changes in pH. Solutions that become more acidic or basic could alter the ionization state of the compound, linking back to the significance of functional groups in solubility behavior.

In summary, the solubility characteristics of 6-chloro-3-[2-(4-pyridyl)ethyl]-1,4-dihydro-2,3-benzoxazine make it intriguing for further exploration, allowing for diverse applications in fields such as pharmaceuticals and materials science.

Interesting facts

6-Chloro-3-[2-(4-pyridyl)ethyl]-1,4-dihydro-2,3-benzoxazine

The compound 6-chloro-3-[2-(4-pyridyl)ethyl]-1,4-dihydro-2,3-benzoxazine is an intriguing member of the benzoxazine family. This class of compounds has garnered significant interest for its diverse applications in medicinal chemistry and materials science. Here are some interesting facts to consider:

Structural Characteristics

  • Benzoxazine structure: The core benzoxazine structure features a unique ring system that contributes to its reactivity and stability.
  • Substituents: The presence of the chloro group and pyridyl moiety enhances its potential biological activity, making it a prime candidate for drug development.

Biological Activity

  • This compound is under investigation for its antitumor properties, demonstrating that alterations in its structure can lead to significant changes in biological efficacy.
  • The pyridyl substituent is known for its ability to interact with biological targets, enhancing the compound's effectiveness.

Research and Applications

Recent studies have indicated that benzoxazines, including this compound, can be used in:

  • Drug design: The specific structure allows for tailored synthesis targeting various diseases, particularly cancers.
  • Materials science: Due to their unique thermal properties, they are also being studied for applications in high-performance materials.

Conclusion

In summary, 6-chloro-3-[2-(4-pyridyl)ethyl]-1,4-dihydro-2,3-benzoxazine is more than just a chemical compound; it represents a fusion of synthetic organic chemistry and potential therapeutic applications. The continued exploration of its properties may unlock new avenues in both healthcare and materials innovation.