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Cefaclor

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Identification
Molecular formula
C15H14ClFN3NaO4S
CAS number
70356-03-5
IUPAC name
sodium;6-[[3-(2-chloro-6-fluoro-phenyl)-5-methyl-isothiazole-4-carbonyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
State
State
At room temperature, cefaclor is typically in a solid state in the form of a crystalline powder.
Melting point (Celsius)
578.10
Melting point (Kelvin)
851.25
Boiling point (Celsius)
371.10
Boiling point (Kelvin)
644.25
General information
Molecular weight
385.82g/mol
Molar mass
385.8200g/mol
Density
1.4800g/cm3
Appearence
Cefaclor appears as a white to off-white crystalline powder. It is soluble in water, slightly soluble in methanol, and practically insoluble in ethanol and chloroform.
Comment on solubility

Solubility Insights

The solubility of sodium 6-[[3-(2-chloro-6-fluoro-phenyl)-5-methyl-isothiazole-4-carbonyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate can be characterized as follows:

  • Polar Nature: This compound contains a variety of polar functional groups, which can enhance its solubility in polar solvents such as water.
  • Impact of Sodium Salt: Being a sodium salt, it may exhibit increased solubility in aqueous environments due to the favorable interactions of sodium ions with water molecules.
  • Influence of Substituents: The presence of the chlorine and fluorine substituents could affect the overall polarity of the compound, potentially allowing for varied solubility profiles in different solvents.

However, the specific solubility behavior would ultimately depend on:

  1. The *temperature* of the solvent.
  2. The *presence of other solutes* in the solution.
  3. The *pH* of the solution, especially given the presence of carboxylate groups.

In practical applications, one might find that this compound shows moderate to high solubility in biological systems, which can be advantageous for pharmacological activities. As with many complex organic compounds, empirical solubility tests would provide the most reliable insights.

Interesting facts

Exploring Sodium 6-[[3-(2-chloro-6-fluoro-phenyl)-5-methyl-isothiazole-4-carbonyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate

Sodium 6-[[3-(2-chloro-6-fluoro-phenyl)-5-methyl-isothiazole-4-carbonyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate represents a fascinating realm of chemical innovation and potential. Here are some notable aspects that make this compound particularly interesting:

  • Pharmaceutical Potential: This compound is a derivative linked to isothiazole, which is notable for its biological activity. Isothiazoles are integral in the development of various pharmaceuticals, especially in the realms of anti-cancer and anti-inflammatory agents.
  • Structural Uniqueness: The bicyclic structure of this compound showcases an intricate arrangement that influences its reactivity. The integration of thia and azabicyclic components presents a unique scaffold that can lead to diverse biological activities.
  • Fluorine's Role: The presence of fluorine in the compound is significant. Fluorinated compounds are known for their enhanced metabolic stability and lipophilicity, which can lead to greater efficacy in drug design.
  • Research Applications: Ongoing studies delve into the mechanism of action of this compound within biological systems. Understanding how such structures interact at the molecular level can guide further synthetic modifications to improve their therapeutic potential.
  • Complex Synthesis: The synthesis of this compound exemplifies the challenges and intricacies faced in organic chemistry. It serves as a perfect case study for students interested in synthetic pathways and the importance of strategic planning in organic synthesis.

In summary, Sodium 6-[[3-(2-chloro-6-fluoro-phenyl)-5-methyl-isothiazole-4-carbonyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate is not just another chemical compound; it is a portal to a deeper understanding of medicinal chemistry and the development of new therapies. As the field progresses, compounds like this one pave the way for novel drug discoveries that could have a significant impact on human health.