CAS 41651-87-0

Benzoic acid, 4-[[(aminoiminomethyl)amino]methyl]-

Description:

Benzoic acid, 4-[[(aminoiminomethyl)amino]methyl]- is a chemical compound characterized by its structure, which includes a benzoic acid moiety substituted with an amino group and an imino group. This compound is part of the broader class of benzoic acids, which are known for their aromatic properties and ability to form hydrogen bonds due to the presence of the carboxylic acid functional group. The presence of the amino and imino groups suggests potential for various interactions, including hydrogen bonding and coordination with metal ions, which may enhance its reactivity and solubility in polar solvents. This compound may exhibit biological activity, making it of interest in pharmaceutical and biochemical research. Its CAS number, 41651-87-0, allows for precise identification in chemical databases. Overall, the unique combination of functional groups in this compound contributes to its potential applications in various fields, including medicinal chemistry and materials science.

Formula: C₉H₁₁N₃O₂

4-{[(Diaminomethylidene)amino]methyl}benzoic acid

CAS: 41651-87-0

4-(Diaminomethylidene)amino-N-methylbenzoic acid (DABA) is a potent histone deacetylase inhibitor that has been shown to inhibit the growth of cancer cells in vitro. DABA binds to the hydrophobic pocket of the acetyltransferase domain of the HDAC enzyme and prevents its interaction with the substrate lysine, inhibiting histone acetylation. In addition, DABA also inhibits platelet aggregation by reducing ATP production in platelets, which may be due to its ability to inhibit protein kinase A activity. The molecular modeling study demonstrated that DABA fits well into the hydrophobic pocket of HDAC2, with potential for binding to other HDACs.

Formula: C₉H₁₁N₃O₂

Purity: Min. 95%

Molecular weight: 193.2 g/mol

Ref: 3D-RBA65187