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Efavirenz

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Identification
Molecular formula
C14H9ClF3NO2
CAS number
154598-52-4
IUPAC name
ethyl N-[1-(4-fluorophenyl)ethylamino]carbamate
State
State
Efavirenz is typically in a solid state at room temperature and is usually available as tablets or capsules for therapeutic use.
Melting point (Celsius)
137.00
Melting point (Kelvin)
410.00
Boiling point (Celsius)
534.30
Boiling point (Kelvin)
807.30
General information
Molecular weight
315.68g/mol
Molar mass
315.6840g/mol
Density
1.3406g/cm3
Appearence

Efavirenz is a white to slightly pink crystalline powder. It is generally odorless or may have a faint characteristic odor.

Comment on solubility

Solubility of Ethyl N-[1-(4-fluorophenyl)ethylamino]carbamate

Ethyl N-[1-(4-fluorophenyl)ethylamino]carbamate, with the chemical formula C14H18FNO2, exhibits notable trends in solubility that are influenced by its chemical structure.

Its solubility characteristics can generally be summarized as follows:

  • Polar and Nonpolar Solvent Compatibility: This compound shows better solubility in polar solvents due to the presence of the carbamate functional group.
  • Influence of the Fluorine Atom: The presence of the fluorinated phenyl group may enhance solubility in certain organic solvents due to dipole interactions.
  • Temperature Dependence: Solubility may increase with temperature, a common trend in many organic compounds.

In terms of specific solubility behavior:

  • It is likely to be soluble in water to some extent, though the degree of solubility may vary.
  • It can be expected to have good solubility in organic solvents such as ethanol, methanol, or dimethyl sulfoxide (DMSO).

As a rule of thumb, compounds containing nitrogen atoms and polar functional groups often exhibit higher solubility in polar solvents. Therefore, ethyl N-[1-(4-fluorophenyl)ethylamino]carbamate likely fits this paradigm effectively.

In conclusion, while this compound may demonstrate certain solubility properties, it is advisable to conduct specific experimental assessments to attain accurate solubility data under varying environmental conditions.

Interesting facts

Interesting Facts about Ethyl N-[1-(4-fluorophenyl)ethylamino]carbamate

Ethyl N-[1-(4-fluorophenyl)ethylamino]carbamate is a fascinating compound in the realm of medicinal chemistry and pharmacology. Here are some highlights:

  • Pharmacological Relevance: This compound belongs to a class of drugs known for their impact on various physiological processes, making it significant for research in the treatment of several conditions, including neurological disorders and mental health issues.
  • Fluorine's Influence: The incorporation of a fluorine atom into the aromatic ring is noteworthy. Fluorine can enhance the lipophilicity and metabolic stability of the compound, often leading to improved bioavailability and efficacy in biological systems.
  • Structure-Activity Relationship: The intricate structure of ethyl N-[1-(4-fluorophenyl)ethylamino]carbamate presents a great opportunity for chemists to explore structure-activity relationships (SAR). By modifying different parts of the molecule, researchers can design more effective derivatives.
  • Role in Drug Development: This compound may serve as a lead molecule in drug discovery. Its structural components can provide insights into the design of novel drugs that are more selective, reducing side effects.
  • Impact on Research: Studies involving this compound contribute significantly to the understanding of target receptor interactions and can pave the way for developing new therapeutic agents aimed at specific biological pathways.

Overall, the study of ethyl N-[1-(4-fluorophenyl)ethylamino]carbamate not only offers insight into the rich field of medicinal chemistry but also exemplifies the ongoing quest for innovative solutions to complex health challenges.

Synonyms
1478-87-1
BRN 0749293
Ethyl (p-fluoro-alpha-methylbenzyl)carbazate
CARBAZIC ACID, 3-(p-FLUORO-alpha-METHYLBENZYL)-, ETHYL ESTER
ethyl N-[1-(4-fluorophenyl)ethylamino]carbamate
N/'-(p-Fluoro-alpha-methylbenzyl)carbazic acid ethyl ester
DTXSID90933212
Ethyl hydrogen [1-(4-fluorophenyl)ethyl]carbonohydrazonate