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CAS 741731-81-7

:

2-[[5-(4-Fluorophenyl)-4-[(tetrahydro-2-furanyl)methyl]-4H-1,2,4-triazol-3-yl]thio]acetic acid

Description:
2-[[5-(4-Fluorophenyl)-4-[(tetrahydro-2-furanyl)methyl]-4H-1,2,4-triazol-3-yl]thio]acetic acid, with CAS number 741731-81-7, is a chemical compound characterized by its complex structure, which includes a triazole ring, a thiol group, and an acetic acid moiety. This compound features a fluorophenyl substituent that enhances its biological activity and solubility properties. The presence of the tetrahydro-2-furanyl group contributes to its lipophilicity, potentially influencing its pharmacokinetic profile. As a triazole derivative, it may exhibit antifungal or antimicrobial properties, making it of interest in medicinal chemistry. The thiol group can participate in various chemical reactions, including nucleophilic substitutions and redox reactions, which may be relevant in biological systems. Overall, this compound's unique structural features suggest potential applications in pharmaceuticals, particularly in the development of new therapeutic agents. However, specific biological activity, toxicity, and stability would require further investigation through experimental studies.
Formula:C15H16FN3O3S
InChI:InChI=1S/C15H16FN3O3S/c16-11-5-3-10(4-6-11)14-17-18-15(23-9-13(20)21)19(14)8-12-2-1-7-22-12/h3-6,12H,1-2,7-9H2,(H,20,21)
InChI key:InChIKey=ORDUAXVHGGNNRB-UHFFFAOYSA-N
SMILES:C(N1C(=NN=C1SCC(O)=O)C2=CC=C(F)C=C2)C3CCCO3
Synonyms:
  • 2-[[5-(4-Fluorophenyl)-4-[(tetrahydro-2-furanyl)methyl]-4H-1,2,4-triazol-3-yl]thio]acetic acid
  • Acetic acid, [[5-(4-fluorophenyl)-4-[(tetrahydro-2-furanyl)methyl]-4H-1,2,4-triazol-3-yl]thio]-
  • Acetic acid, 2-[[5-(4-fluorophenyl)-4-[(tetrahydro-2-furanyl)methyl]-4H-1,2,4-triazol-3-yl]thio]-
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