CAS 1185300-38-2

Benzoic acid, 5-amino-2-(4-methyl-1-piperazinyl)-, hydrochloride (1:1)

Description:

Benzoic acid, 5-amino-2-(4-methyl-1-piperazinyl)-, hydrochloride (1:1) is a chemical compound characterized by its structural features that include a benzoic acid moiety and a piperazine ring substituted with a methyl group. This compound typically appears as a white to off-white crystalline solid and is soluble in water due to the presence of the hydrochloride salt, which enhances its solubility compared to its free base form. The presence of the amino group contributes to its potential as a biological active agent, possibly influencing its pharmacological properties. The piperazine ring is known for its role in various pharmaceutical applications, often associated with central nervous system activity. As a hydrochloride salt, it is likely to exhibit improved stability and bioavailability. Safety and handling precautions should be observed, as with many chemical substances, particularly in laboratory settings. Overall, this compound may be of interest in medicinal chemistry and drug development due to its unique structural characteristics and potential therapeutic applications.

Formula: C₁₂H₁₇N₃O₂·ClH

InChI: InChI=1S/C12H17N3O2.ClH/c1-14-4-6-15(7-5-14)11-3-2-9(13)8-10(11)12(16)17;/h2-3,8H,4-7,13H2,1H3,(H,16,17);1H

InChI key: InChIKey=QECCLZCMMWNHHS-UHFFFAOYSA-N

SMILES: C(O)(=O)C1=C(C=CC(N)=C1)N2CCN(C)CC2.Cl

Synonyms:

• Benzoic acid, 5-amino-2-(4-methyl-1-piperazinyl)-, hydrochloride (1:1)