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CAS 1258650-31-5

:

1,4-Benzothiazepine, 7-fluoro-2,3,4,5-tetrahydro-, hydrochloride (1:1)

Description:
1,4-Benzothiazepine, 7-fluoro-2,3,4,5-tetrahydro-, hydrochloride (1:1) is a chemical compound characterized by its unique bicyclic structure, which incorporates both benzene and thiazepine rings. The presence of a fluorine atom at the 7-position contributes to its distinct chemical properties and potential biological activity. This compound is typically encountered as a hydrochloride salt, enhancing its solubility in aqueous environments, which is crucial for pharmaceutical applications. The tetrahydro configuration indicates that the compound has undergone partial hydrogenation, resulting in a saturated structure that may influence its reactivity and interaction with biological targets. As a member of the benzothiazepine family, it may exhibit various pharmacological effects, including potential anxiolytic or anticonvulsant properties, although specific biological activities would depend on further empirical studies. The CAS number 1258650-31-5 serves as a unique identifier for this substance, facilitating its recognition in chemical databases and literature. Overall, this compound represents a significant interest in medicinal chemistry and drug development.
Formula:C9H10FNS·ClH
InChI:InChI=1S/C9H10FNS.ClH/c10-8-1-2-9-7(5-8)6-11-3-4-12-9;/h1-2,5,11H,3-4,6H2;1H
InChI key:InChIKey=XDUNWTIOKNRRTR-UHFFFAOYSA-N
SMILES:FC=1C=C2C(=CC1)SCCNC2.Cl
Synonyms:
  • 1,4-Benzothiazepine, 7-fluoro-2,3,4,5-tetrahydro-, hydrochloride (1:1)
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