CAS 1330583-65-7

Phenylmethyl 4-[[(4-chloro-2-fluorophenyl)amino]methyl]-4-hydroxy-1-piperidinecarboxylate

Description:

Phenylmethyl 4-[[(4-chloro-2-fluorophenyl)amino]methyl]-4-hydroxy-1-piperidinecarboxylate, identified by its CAS number 1330583-65-7, is a chemical compound that belongs to the class of piperidine derivatives. This substance features a piperidine ring, which is a six-membered nitrogen-containing heterocycle, and is characterized by the presence of a hydroxy group and a carboxylate moiety. The compound also contains a phenylmethyl group and a substituted aromatic ring with both chlorine and fluorine atoms, indicating potential biological activity and interactions. Its structural complexity suggests that it may exhibit specific pharmacological properties, possibly acting as a ligand for certain biological targets. The presence of halogen substituents can influence its lipophilicity and reactivity, which are important factors in drug design and development. As with many organic compounds, its solubility, stability, and reactivity will depend on environmental conditions such as pH and temperature. Further studies would be necessary to fully elucidate its properties and potential applications in medicinal chemistry.

Formula: C₂₀H₂₂ClFN₂O₃

InChI: InChI=1S/C20H22ClFN2O3/c21-16-6-7-18(17(22)12-16)23-14-20(26)8-10-24(11-9-20)19(25)27-13-15-4-2-1-3-5-15/h1-7,12,23,26H,8-11,13-14H2

InChI key: InChIKey=JYNDUQOGHSDGQE-UHFFFAOYSA-N

SMILES: C(NC1=C(F)C=C(Cl)C=C1)C2(O)CCN(C(OCC3=CC=CC=C3)=O)CC2

Synonyms:

• 1-Piperidinecarboxylic acid, 4-[[(4-chloro-2-fluorophenyl)amino]methyl]-4-hydroxy-, phenylmethyl ester
• Phenylmethyl 4-[[(4-chloro-2-fluorophenyl)amino]methyl]-4-hydroxy-1-piperidinecarboxylate