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CAS 328546-79-8

:

1,2,3,4-Tetrahydro-9-iodo-5H-1,4-benzodiazepin-5-one

Description:
1,2,3,4-Tetrahydro-9-iodo-5H-1,4-benzodiazepin-5-one is a chemical compound belonging to the benzodiazepine class, characterized by its bicyclic structure that includes a fused benzene and diazepine ring. This compound features a tetrahydro configuration, indicating the presence of four hydrogen atoms that saturate the ring system, contributing to its stability and reactivity. The iodine substituent at the 9-position enhances its biological activity and may influence its pharmacological properties. The presence of a carbonyl group (ketone) at the 5-position is significant for its chemical reactivity and potential interactions with biological targets. This compound is of interest in medicinal chemistry, particularly for its potential therapeutic applications, which may include anxiolytic or sedative effects, similar to other benzodiazepines. Its unique structure may also provide avenues for further research into its synthesis and modification, aiming to optimize its efficacy and safety profile. As with many benzodiazepines, careful consideration of its pharmacodynamics and pharmacokinetics is essential for understanding its behavior in biological systems.
Formula:C9H9IN2O
InChI:InChI=1S/C9H9IN2O/c10-7-3-1-2-6-8(7)11-4-5-12-9(6)13/h1-3,11H,4-5H2,(H,12,13)
InChI key:InChIKey=HCESKYHVILECLD-UHFFFAOYSA-N
SMILES:O=C1C=2C(=C(I)C=CC2)NCCN1
Synonyms:
  • 5H-1,4-Benzodiazepin-5-one, 1,2,3,4-tetrahydro-9-iodo-
  • 1,2,3,4-Tetrahydro-9-iodo-5H-1,4-benzodiazepin-5-one
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