CAS 786728-90-3

1-Ethyl 4-[[2-[(2-carboxyethyl)thio]acetyl]amino]benzoate

Description:

1-Ethyl 4-[[2-[(2-carboxyethyl)thio]acetyl]amino]benzoate, with the CAS number 786728-90-3, is a chemical compound that belongs to the class of benzoate esters. It features a complex structure that includes an ethyl group, a carboxyethyl thio group, and an acetylamino moiety, contributing to its potential biological activity. This compound is likely to exhibit moderate solubility in organic solvents due to its ester functional group, while its polar carboxylic acid component may enhance solubility in polar solvents. The presence of the thioether group suggests potential reactivity and interactions with biological systems, making it of interest in medicinal chemistry. Additionally, the compound may possess specific pharmacological properties, although detailed studies would be necessary to elucidate its biological effects and mechanisms of action. As with many synthetic compounds, safety data and handling precautions should be considered, particularly regarding its potential toxicity and environmental impact.

Formula: C₁₄H₁₇NO₅S

InChI: InChI=1S/C14H17NO5S/c1-2-20-14(19)10-3-5-11(6-4-10)15-12(16)9-21-8-7-13(17)18/h3-6H,2,7-9H2,1H3,(H,15,16)(H,17,18)

InChI key: InChIKey=ZNAKYJRRHDQHKE-UHFFFAOYSA-N

SMILES: N(C(CSCCC(O)=O)=O)C1=CC=C(C(OCC)=O)C=C1

Synonyms:

• 1-Ethyl 4-[[2-[(2-carboxyethyl)thio]acetyl]amino]benzoate
• Benzoic acid, 4-[[[(2-carboxyethyl)thio]acetyl]amino]-, 1-ethyl ester
• Benzoic acid, 4-[[2-[(2-carboxyethyl)thio]acetyl]amino]-, 1-ethyl ester

3-[({[4-(Ethoxycarbonyl)phenyl]carbamoyl}methyl)sulfanyl]propanoic acid

Controlled Product

CAS: 786728-90-3

3-[({[4-(Ethoxycarbonyl)phenyl]carbamoyl}methyl)sulfanyl]propanoic acid is a research tool that is used as an activator of various receptors, ligands, and ion channels. This compound binds to the ligand binding site of the receptor and causes activation by increasing the rate of ligand-receptor interactions. 3-[({[4-(Ethoxycarbonyl)phenyl]carbamoyl}methyl)sulfanyl]propanoic acid has been shown to inhibit protein synthesis in cells by inhibiting peptide bond formation.

Formula: C₁₄H₁₇NO₅S

Purity: Min. 95%

Molecular weight: 311.36 g/mol

Ref: 3D-LGB72890