CAS 1245649-47-1

(2S)-4-(Phenylmethyl)-2-piperazinecarboxylic acid

Description:

(2S)-4-(Phenylmethyl)-2-piperazinecarboxylic acid, identified by its CAS number 1245649-47-1, is a chemical compound characterized by its piperazine core, which is a six-membered ring containing two nitrogen atoms. This compound features a phenylmethyl group, contributing to its lipophilicity and potential interactions with biological targets. The presence of a carboxylic acid functional group indicates that it can participate in acid-base reactions and may exhibit polar characteristics, influencing its solubility in various solvents. The stereochemistry denoted by (2S) suggests that it has specific spatial arrangements that can affect its biological activity and interaction with receptors. Such compounds are often studied for their pharmacological properties, particularly in the context of drug design and development, as they may exhibit activity in central nervous system pathways or other therapeutic areas. Overall, the unique structural features of this compound make it a subject of interest in medicinal chemistry and related fields.

Formula: C₁₂H₁₆N₂O₂

InChI: InChI=1S/C12H16N2O2/c15-12(16)11-9-14(7-6-13-11)8-10-4-2-1-3-5-10/h1-5,11,13H,6-9H2,(H,15,16)/t11-/m0/s1

InChI key: InChIKey=RBMNCOYMAYDTOP-NSHDSACASA-N

SMILES: C(N1C[C@@H](C(O)=O)NCC1)C2=CC=CC=C2

Synonyms:

• 2-Piperazinecarboxylic acid, 4-(phenylmethyl)-, (2S)-
• (2S)-4-(Phenylmethyl)-2-piperazinecarboxylic acid