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CAS 886364-36-9

:

tert-butyl 7-fluoro-1,2,3,5-tetrahydro-1,4-benzodiazepine-4-carboxylate

Description:
Tert-butyl 7-fluoro-1,2,3,5-tetrahydro-1,4-benzodiazepine-4-carboxylate is a chemical compound characterized by its complex bicyclic structure, which includes a benzodiazepine core. This compound features a tert-butyl ester group, enhancing its lipophilicity and potentially influencing its pharmacokinetic properties. The presence of a fluorine atom at the 7-position of the benzodiazepine ring may impart unique electronic and steric effects, potentially affecting its biological activity. The tetrahydro configuration indicates that the compound is saturated, which can influence its reactivity and stability. As a carboxylate, it may exhibit acidic properties, and its solubility can vary depending on the solvent used. This compound is of interest in medicinal chemistry, particularly for its potential applications in developing therapeutic agents targeting the central nervous system. Its specific interactions with biological targets would depend on its conformation and the presence of functional groups that facilitate binding to receptors or enzymes.
Formula:C14H19FN2O2
InChI:InChI=1/C14H19FN2O2/c1-14(2,3)19-13(18)17-7-6-16-12-5-4-11(15)8-10(12)9-17/h4-5,8,16H,6-7,9H2,1-3H3
SMILES:CC(C)(C)OC(=O)N1CCNc2ccc(cc2C1)F
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