CAS 886360-86-7

Methyl 5-amino-2-[4-(phenylmethyl)-1-piperazinyl]benzoate

Description:

Methyl 5-amino-2-[4-(phenylmethyl)-1-piperazinyl]benzoate, with the CAS number 886360-86-7, is a chemical compound that belongs to the class of benzoate esters. It features a benzoate moiety substituted with an amino group and a piperazine ring, which is further substituted with a phenylmethyl group. This structure suggests potential biological activity, particularly in pharmacology, as piperazine derivatives are often explored for their effects on the central nervous system. The presence of the amino group may enhance solubility and reactivity, while the methyl ester group can influence the compound's lipophilicity and metabolic stability. The compound's molecular structure indicates it may interact with various biological targets, making it of interest in medicinal chemistry. Its synthesis and characterization would typically involve standard organic chemistry techniques, and its properties, such as solubility, melting point, and spectral data, would be essential for further applications in research or drug development.

Formula: C₁₉H₂₃N₃O₂

InChI: InChI=1S/C19H23N3O2/c1-24-19(23)17-13-16(20)7-8-18(17)22-11-9-21(10-12-22)14-15-5-3-2-4-6-15/h2-8,13H,9-12,14,20H2,1H3

InChI key: InChIKey=FMTNSDJQEQJTID-UHFFFAOYSA-N

SMILES: C(OC)(=O)C1=C(C=CC(N)=C1)N2CCN(CC3=CC=CC=C3)CC2

Synonyms:

• Benzoic acid, 5-amino-2-[4-(phenylmethyl)-1-piperazinyl]-, methyl ester
• Methyl 5-amino-2-[4-(phenylmethyl)-1-piperazinyl]benzoate