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Cefatrizine

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Identification
Molecular formula
C18H17N7O5S2
CAS number
51627-14-6
IUPAC name
7-[[2-amino-2-(4-hydroxyphenyl)acetyl]amino]-8-oxo-3-(2H-triazol-4-ylsulfanylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
State
State
At room temperature, cefatrizine is usually in a solid state.
Melting point (Celsius)
228.00
Melting point (Kelvin)
501.00
Boiling point (Celsius)
0.00
Boiling point (Kelvin)
0.00
General information
Molecular weight
488.50g/mol
Molar mass
488.4970g/mol
Density
1.5000g/cm3
Appearence

Cefatrizine is usually a fine, crystalline powder. The color can vary from white to slightly off-white.

Comment on solubility

Solubility of 7-[[2-amino-2-(4-hydroxyphenyl)acetyl]amino]-8-oxo-3-(2H-triazol-4-ylsulfanylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (C18H17N7O5S2)

The solubility of this complex compound is influenced by various factors such as its structure and functional groups. Generally, the solubility characteristics can be summarized as follows:

  • Polar Functional Groups: The presence of several polar functional groups, including amino (–NH2), hydroxyl (–OH), and carboxylic acid (–COOH), suggests that the compound may have improved solubility in polar solvents like water.
  • Hydrogen Bonding: The ability of the compound to form hydrogen bonds due to its functional groups could enhance its solubility, especially in aqueous solutions.
  • Hydrophobic Regions: However, the bicyclic structure may introduce some hydrophobic characteristics, which could limit its solubility in highly polar solvents.
  • Temperature Dependence: The solubility might vary with temperature; often, increasing temperature can lead to higher solute solubility in solvents.

In conclusion, despite the potential for good solubility due to multiple polar groups, one must note that the overall solubility of this compound in various solvents will require empirical testing to obtain precise data. As with many complex molecules, empirical solubility data can reveal unexpected behaviors in various media.

Interesting facts

Interesting Facts about 7-[[2-amino-2-(4-hydroxyphenyl)acetyl]amino]-8-oxo-3-(2H-triazol-4-ylsulfanylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

This compound is a fascinating example of a complex azabicyclic structure that embodies a rich interplay of various chemical functionalities. Here are some intriguing aspects of this compound:

  • Chemical Diversity: The structure includes an amine group, a hydroxyl group, and a triazole ring, showcasing a remarkable level of chemical diversity. This complexity opens up pathways for diverse reactivity and biological activity.
  • Potential Therapeutic Applications: Given its structural motifs, this compound may exhibit significant pharmacological properties. Triazole derivatives are often linked to antifungal and anticancer activities, indicating potential therapeutic uses.
  • Structural Innovation: The bicyclic arrangement of the compound contributes to its unique spatial arrangement, which is crucial in interactions with biological targets, enhancing its potential as a drug lead candidate.
  • Interdisciplinary Connections: This compound bridges various fields such as medicinal chemistry, pharmacology, and biochemistry. Such compounds often become subjects of study in drug design, leading to innovations in treatment methods.
  • Biological Relevance: Compounds with similar structures have been investigated for their ability to inhibit certain enzymes, suggesting that this compound might interfere with crucial biochemical pathways in pathogens or cancer cells.

In the words of renowned chemist Linus Pauling, "The best way to have a good idea is to have a lot of ideas." The complexity of this compound inspires further exploration and potential discoveries in the realm of chemical and biological sciences. Its unique properties could pave the way for advancements in therapeutic development and understanding intricate biochemical interactions.

Synonyms
CHEMBL4789690
DTXSID70860633
AKOS015961778
cefatrizine (stereochemistry undefined)
NCGC00482867-01
AC-14916
DB-071385
Q15709236
7-[2-Amino(4-hydroxyphenyl)acetamido]-8-oxo-3-{[(1H-1,2,3-triazol-4-yl)sulfanyl]methyl}-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid