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Etoricoxib

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Identification
Molecular formula
C18H15ClN2O2S
CAS number
202409-33-4
IUPAC name
N,N-diethyl-2-[(17-methoxyimino-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-yl)oxy]ethanamine
State
State

Etoricoxib is typically found in solid state at room temperature.

Melting point (Celsius)
136.50
Melting point (Kelvin)
409.65
Boiling point (Celsius)
435.85
Boiling point (Kelvin)
708.85
General information
Molecular weight
358.48g/mol
Molar mass
358.4770g/mol
Density
1.1900g/cm3
Appearence

Etoricoxib is a white to off-white crystalline powder.

Comment on solubility

Solubility of N,N-diethyl-2-[(17-methoxyimino-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-yl)oxy]ethanamine

The solubility of N,N-diethyl-2-[(17-methoxyimino-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-yl)oxy]ethanamine can be quite complex due to its unique chemical structure. Here are some key points regarding its solubility:

  • Polar vs Nonpolar: The compound has both polar and nonpolar characteristics, which may influence its solubility in various solvents.
  • Organic Solvents: It is likely to exhibit better solubility in organic solvents such as ethanol and methanol compared to water, given its extensive alkyl and aromatic structural elements.
  • Hydrogen Bonding: The presence of hydroxyl groups may allow for hydrogen bonding, potentially increasing solubility in polar solvents to some extent.
  • Concentration Factors: Its solubility might change significantly with concentration; hence, it's important to consider the environmental conditions.
  • Stability: Solvent interactions could also affect the stability of the compound, which in turn can influence solubility.

In conclusion, while there are indications that N,N-diethyl-2-[(17-methoxyimino-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-yl)oxy]ethanamine may favor solubility in organic solvents, the specific conditions need to be carefully evaluated to determine its exact behavior in various environments.

Interesting facts

Exploring N,N-Diethyl-2-[(17-Methoxyimino-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-yl)oxy]ethanamine

N,N-Diethyl-2-[(17-methoxyimino-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-yl)oxy]ethanamine, often simply referred to by its structural components, is a fascinating compound within the realm of organic chemistry. With complex structural characteristics, it exemplifies the intricate designs one can achieve in synthetic organic compounds.

Key Features:

  • Structural Complexity: This compound features a multi-cyclic structure that includes a dodecahydronaphthalene framework, contributing to its unique properties and potential biological activity.
  • Functional Groups: Incorporating methoxyimino and ethyl amine functionalities, it hints at possible reactivity patterns conducive to various chemical transformations.
  • Pharmaceutical Potential: The intricate structure suggests potential medicinal properties, making it an interesting candidate for therapeutic application research, particularly in drug development.

Scientists are continually amazed by the dual functionality some complex organic compounds offer. As noted by many researchers, "The beauty of organic chemistry lies in its ability to create molecules with diverse functionalities that can manifest in life-saving drugs." This assertion resonates deeply in discussions surrounding compounds like N,N-diethyl-2-[(17-methoxyimino-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-yl)oxy]ethanamine.

Furthermore, students exploring such compounds will find that they offer valuable insights into concepts like stereochemistry, reaction mechanisms, and molecular interactions. The study of this compound not only aids in understanding its chemistry but also enhances one’s appreciation for the innovative spirit of chemical synthesis.

Overall, this compound embodies the challenges and excitement at the frontier of chemical science, showcasing how complex structures can lead to the discovery of novel solutions in medicinal chemistry and beyond.

Synonyms
6157-77-3
DTXSID00274729
N,N-Diethyl-2-{[17-(methoxyimino)androst-5-en-3-yl]oxy}ethan-1-amine