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CAS 886364-39-2

:

1,1-Dimethylethyl 1,2,3,5-tetrahydro-7-hydroxy-4H-1,4-benzodiazepine-4-carboxylate

Description:
1,1-Dimethylethyl 1,2,3,5-tetrahydro-7-hydroxy-4H-1,4-benzodiazepine-4-carboxylate, identified by its CAS number 886364-39-2, is a chemical compound that belongs to the benzodiazepine class. This compound features a bicyclic structure characteristic of benzodiazepines, which typically exhibit psychoactive properties. The presence of the dimethyl group contributes to its steric properties, potentially influencing its biological activity and solubility. The hydroxy group at the 7-position may enhance its interaction with biological targets, such as receptors in the central nervous system. The carboxylate moiety suggests potential for ionic interactions, which can affect its pharmacokinetics and pharmacodynamics. Overall, this compound may be of interest in medicinal chemistry for its potential therapeutic applications, although specific biological activities and safety profiles would require further investigation through experimental studies.
Formula:C14H20N2O3
InChI:InChI=1S/C14H20N2O3/c1-14(2,3)19-13(18)16-7-6-15-12-5-4-11(17)8-10(12)9-16/h4-5,8,15,17H,6-7,9H2,1-3H3
InChI key:InChIKey=FYILRTSVQZCYTE-UHFFFAOYSA-N
SMILES:C(OC(C)(C)C)(=O)N1CC=2C(NCC1)=CC=C(O)C2
Synonyms:
  • 1,1-Dimethylethyl 1,2,3,5-tetrahydro-7-hydroxy-4H-1,4-benzodiazepine-4-carboxylate
  • 4H-1,4-Benzodiazepine-4-carboxylic acid, 1,2,3,5-tetrahydro-7-hydroxy-, 1,1-dimethylethyl ester
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