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CAS 108877-44-7

:

2-(6,7,8,9-TETRAHYDRO-5H-[1,2,4]TRIAZOLO[4,3-A]AZEPIN-3-YL)-PHENOL

Description:
2-(6,7,8,9-Tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)-phenol, with the CAS number 108877-44-7, is a chemical compound characterized by its complex bicyclic structure that incorporates both a phenolic group and a triazoloazepine moiety. This compound features a tetrahydrotriazole ring fused to an azepine, contributing to its unique pharmacological properties. The presence of the hydroxyl group (-OH) on the phenol enhances its potential for hydrogen bonding, which may influence its solubility and reactivity. The compound is of interest in medicinal chemistry, particularly for its potential biological activities, which may include effects on neurotransmitter systems or other cellular pathways. Its structural features suggest that it could interact with various biological targets, making it a candidate for further research in drug development. As with many organic compounds, its stability, solubility, and reactivity can be influenced by environmental conditions such as pH and temperature.
Formula:C13H15N3O
InChI:InChI=1/C13H15N3O/c17-11-7-4-3-6-10(11)13-15-14-12-8-2-1-5-9-16(12)13/h3-4,6-7,17H,1-2,5,8-9H2
SMILES:C1CCc2nnc(c3ccccc3O)n2CC1
Synonyms:
  • 6-(2,5,6,7,8,9-hexahydro-3H-[1,2,4]triazolo[4,3-a]azepin-3-ylidene)cyclohexa-2,4-dien-1-one
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