CAS 1262757-33-4

1,1-Dimethylethyl 6-fluoro-4,5-dihydrospiro[1,5-benzoxazepine-2(3H),4′-piperidine]-1′-carboxylate

Description:

1,1-Dimethylethyl 6-fluoro-4,5-dihydrospiro[1,5-benzoxazepine-2(3H),4′-piperidine]-1′-carboxylate, identified by its CAS number 1262757-33-4, is a synthetic organic compound characterized by its complex molecular structure, which includes a spirocyclic framework. This compound features a benzoxazepine moiety fused with a piperidine ring, contributing to its potential biological activity. The presence of a fluoro substituent enhances its lipophilicity and may influence its pharmacological properties. The dimethyl group at the 1-position of the ethyl group suggests steric hindrance, which can affect the compound's reactivity and interaction with biological targets. As a carboxylate ester, it may exhibit stability under certain conditions while being susceptible to hydrolysis in the presence of nucleophiles. The compound's unique structure positions it as a candidate for research in medicinal chemistry, particularly in the development of novel therapeutic agents. However, specific data regarding its physical properties, biological activity, and safety profile would require further investigation through experimental studies.

Formula: C₁₈H₂₅FN₂O₃

InChI: InChI=1S/C18H25FN2O3/c1-17(2,3)24-16(22)21-11-8-18(9-12-21)7-10-20-15-13(19)5-4-6-14(15)23-18/h4-6,20H,7-12H2,1-3H3

InChI key: InChIKey=MTPHDWOQRBEDOX-UHFFFAOYSA-N

SMILES: C(OC(C)(C)C)(=O)N1CCC2(OC=3C(NCC2)=C(F)C=CC3)CC1

Synonyms:

• Spiro[1,5-benzoxazepine-2(3H),4′-piperidine]-1′-carboxylic acid, 6-fluoro-4,5-dihydro-, 1,1-dimethylethyl ester
• 1,1-Dimethylethyl 6-fluoro-4,5-dihydrospiro[1,5-benzoxazepine-2(3H),4′-piperidine]-1′-carboxylate