CAS 79516-67-9

4-Piperidinecarboxylic acid, 1-[cis-4-cyano-4-(4-fluorophenyl)cyclohexyl]-3-methyl-4-phenyl-, hydrochloride (1:1), (3S,4R)-rel-

Description:

4-Piperidinecarboxylic acid, 1-[cis-4-cyano-4-(4-fluorophenyl)cyclohexyl]-3-methyl-4-phenyl-, hydrochloride (1:1), (3S,4R)-rel- is a complex organic compound characterized by its piperidine and cyclohexyl moieties, which contribute to its structural and functional properties. This compound features a piperidine ring, which is a six-membered nitrogen-containing heterocycle, and is substituted with various functional groups, including a cyano group and a fluorophenyl group, enhancing its potential biological activity. The hydrochloride salt form indicates that it is a hydrochloride, which often improves solubility and stability in aqueous environments. The specific stereochemistry (3S,4R) suggests that the compound has defined chiral centers, which can significantly influence its pharmacological properties and interactions with biological targets. Overall, this compound may exhibit interesting pharmacological activities, making it a subject of interest in medicinal chemistry and drug development. However, detailed studies would be necessary to fully elucidate its properties and potential applications.

Formula: C₂₆H₂₉FN₂O₂·ClH

InChI: InChI=1/C26H29FN2O2.ClH/c1-19-17-29(16-15-26(19,24(30)31)21-5-3-2-4-6-21)23-11-13-25(18-28,14-12-23)20-7-9-22(27)10-8-20;/h2-10,19,23H,11-17H2,1H3,(H,30,31);1H/t19-,23-,25-,26-;/s2

InChI key: InChIKey=OICFWWJHIMKBCD-TVEOZAJDNA-N

SMILES: C(O)(=O)[C@]1([C@H](C)CN(CC1)[C@@H]2CC[C@](C#N)(CC2)C3=CC=C(F)C=C3)C4=CC=CC=C4.Cl

Synonyms:

• 4-Piperidinecarboxylic acid, 1-[cis-4-cyano-4-(4-fluorophenyl)cyclohexyl]-3-methyl-4-phenyl-, hydrochloride (1:1), (3S,4R)-rel-
• 4-Piperidinecarboxylic acid, 1-[4-cyano-4-(4-fluorophenyl)cyclohexyl]-3-methyl-4-phenyl-, monohydrochloride, [1(cis),3α,4β]-(±)-
• 4-Piperidinecarboxylic acid, 1-[4-cyano-4-(4-fluorophenyl)cyclohexyl]-3-methyl-4-phenyl-, monohydrochloride, [1(cis),3α,4β]-

(3S,4R)-Cabastine-D4 Hydrochloride

Controlled Product

CAS: 724694-34-2, 79516-67-9

Formula: C₂₆H₂₅D₄FN₂O₂•(HCl)

Color and Shape: Neat

Molecular weight: 461.01

Ref: TR-C045502