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CAS 728864-99-1

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4-Thiazolecarboxylic acid, 2-[(3-bromophenyl)amino]-

Description:
4-Thiazolecarboxylic acid, 2-[(3-bromophenyl)amino]- is an organic compound characterized by its thiazole ring, which is a five-membered heterocyclic structure containing sulfur and nitrogen. This compound features a carboxylic acid functional group, contributing to its acidic properties, and an amino group attached to a bromophenyl moiety, which enhances its potential for biological activity. The presence of the bromine atom on the phenyl ring can influence the compound's reactivity and lipophilicity, making it of interest in medicinal chemistry. The thiazole and phenyl groups can participate in various chemical interactions, including hydrogen bonding and π-π stacking, which may be relevant in drug design. This compound may exhibit properties such as antimicrobial or anti-inflammatory activity, although specific biological activities would require empirical investigation. Its molecular structure suggests potential applications in pharmaceuticals, agrochemicals, or as a building block in organic synthesis. Proper handling and safety measures should be observed due to the presence of bromine and the acidic nature of the carboxylic group.
Formula:C10H7BrN2O2S
InChI:InChI=1S/C10H7BrN2O2S/c11-6-2-1-3-7(4-6)12-10-13-8(5-16-10)9(14)15/h1-5H,(H,12,13)(H,14,15)
InChI key:InChIKey=YXULPKIJBKIWEV-UHFFFAOYSA-N
SMILES:N(C1=NC(C(O)=O)=CS1)C2=CC(Br)=CC=C2
Synonyms:
  • 4-Thiazolecarboxylic acid, 2-[(3-bromophenyl)amino]-
  • 2-(3-Bromo-phenylamino)-thiazole-4-carboxylic acid
  • 2-[(3-Bromophenyl)amino]-1,3-thiazole-4-carboxylic acid
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