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Pralatrexate

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Identification
Molecular formula
C23H23ClN10O5
CAS number
146464-95-1
IUPAC name
ethyl 4-[2,4-diamino-6-[3-[2-chloroethyl(ethyl)amino]propylamino]pyrimidin-5-yl]azobenzoate
State
State

Pralatrexate is a solid at room temperature. It is typically available as a powder for pharmaceutical use and is used in the formulation of injectable medications.

Melting point (Celsius)
0.00
Melting point (Kelvin)
0.00
Boiling point (Celsius)
0.00
Boiling point (Kelvin)
0.00
General information
Molecular weight
477.93g/mol
Molar mass
477.8750g/mol
Density
1.2210g/cm3
Appearence

Pralatrexate appears as a light yellow to yellow powder. Its appearance can vary slightly depending on the physical form and impurities present. As a solid, it is typically handled in a finely powdered form.

Comment on solubility

Solubility of Ethyl 4-[2,4-diamino-6-[3-[2-chloroethyl(ethyl)amino]propylamino]pyrimidin-5-yl]azobenzoate

The solubility of ethyl 4-[2,4-diamino-6-[3-[2-chloroethyl(ethyl)amino]propylamino]pyrimidin-5-yl]azobenzoate can be quite complex due to its multi-functional character. When evaluating the solubility of this compound, several factors should be examined:

  • Polarity: The presence of both polar and non-polar functional groups can significantly affect solubility. The azobenzoate moiety introduces polar characteristics that may enhance solubility in polar solvents.
  • Hydrophobic Interactions: The ethyl groups and the chloroethylamino part introduce hydrophobic characteristics, which may limit solubility in highly polar solvents, suggesting a preference for organic solvents.
  • Temperature Effects: Temperature can influence solubility; typically, solubility increases with temperature for many organic compounds. However, specific solvent interactions may vary.
  • pH Dependence: The amine groups present can undergo protonation or deprotonation depending on the pH, which may further affect the compound's solubility in aqueous environments.

In conclusion, while predictions cannot be wholly definitive without empirical data, it is reasonable to expect that this compound will exhibit moderate solubility in some organic solvents and potentially lower solubility in pure water due to its complex structural composition and functional groups.

Interesting facts

Interesting Facts about Ethyl 4-[2,4-Diamino-6-[3-[2-Chloroethyl(ethyl)amino]propylamino]pyrimidin-5-yl]azobenzoate

Ethyl 4-[2,4-diamino-6-[3-[2-chloroethyl(ethyl)amino]propylamino]pyrimidin-5-yl]azobenzoate is a fascinating compound with numerous potential applications, particularly in the field of medicinal chemistry. Here are some insightful observations:

  • Potential Applications: This compound has garnered attention for its role as a therapeutic agent. Its unique structure allows it to interact with various biological targets, opening avenues for drug development, especially in cancer treatment.
  • Structural Diversity: The presence of both pyrimidine and azobenzoate moieties contributes to the compound's intriguing characteristics. The interplay of these functional groups enhances its chemical reactivity and biological properties.
  • Mechanism of Action: Researchers are particularly interested in the mechanism through which this compound operates. It appears that the amine groups play a critical role in binding to target proteins, potentially inhibiting cancer cell growth.
  • Modifications and Variants: The versatility of this compound encourages scientists to modify its structure to improve efficacy or reduce toxicity. Small changes could lead to significantly different pharmacological profiles.
  • Research Potential: Numerous studies are underway to understand the full spectrum of effects and interactions of this compound. Its complexity challenges researchers, but it also means there are many possibilities for innovation.

In summary, Ethyl 4-[2,4-diamino-6-[3-[2-chloroethyl(ethyl)amino]propylamino]pyrimidin-5-yl]azobenzoate embodies a rich combination of chemical structure and potential biological activity. As we continue to explore its capabilities, this compound may unlock new frontiers in pharmaceutical design and therapeutic applications.