99592-24-2

Basic information

• Product Name: 1H-Imidazole, 1-[2-(benzo[b]thien-3-ylmethoxy)-2-(2,4-dichlorophenyl)ethyl]-
• CAS NO: 99592-24-2
• Molecular Formula: C20H16Cl2N2OS
• Molecular Weight: 403.332
• Mol File: 99592-24-2.mol
• Article Data: 4

Chemical Properties

• CAS DataBase Reference: 1H-Imidazole, 1-[2-(benzo[b]thien-3-ylmethoxy)-2-(2,4-dichlorophenyl)ethyl]-(CAS DataBase Reference)
• NIST Chemistry Reference: 1H-Imidazole, 1-[2-(benzo[b]thien-3-ylmethoxy)-2-(2,4-dichlorophenyl)ethyl]-(99592-24-2)
• EPA Substance Registry System: 1H-Imidazole, 1-[2-(benzo[b]thien-3-ylmethoxy)-2-(2,4-dichlorophenyl)ethyl]-(99592-24-2)

Safety Data

• Hazardous Substances Data: 99592-24-2(Hazardous Substances Data)

Upstream product

• 24155-42-8 1-(2,4-dichlorophenyl)-2-(1H-imidazol-1-yl)ethan-1-ol 
• 2234-16-4 1-(2,4-dichlorophenyl)ethan-1-one 
• 2631-72-3 2,4-dichlorophenacyl bromide 
• 46503-52-0 1-(2,4-dichlorophenyl)-2-(imidazol-1-yl)ethanone 
• 1196-19-6 3-(bromomethyl)benzothiophene 

Relevant articles and documents

Novel BuChE-IDO1 inhibitors from sertaconazole: Virtual screening, chemical optimization and molecular modeling studies

In our effort towards the identification of novel BuChE-IDO1 dual-targeted inhibitor for the treatment of Alzheimer's disease (AD), sertaconazole was identified through a combination of structure-based virtual screening followed by MM-GBSA rescoring. Preliminary chemical optimization was performed to develop more potent and selective sertaconazole analogues. In consideration of the selectivity and the inhibitory activity against target proteins, compounds 5c and 5d were selected for the next study. Further modification of compound 5c led to the generation of compound 10g with notably improved selectivity towards BuChE versus AChE. The present study provided us with a good starting point to further design potent and selective BuChE-IDO1 inhibitors, which may benefit the treatment of late stage AD.

Synthesis and antimycotic activity of (benzo[b]thienyl)methyl ethers of 1-(2,4-dichlorophenyl)-2-(1H-imidazol-1-yl)-ethanol and of (Z)-1-(2,4-dichlorophenyl)-2-(1H-imidazol-1-yl)ethanone oxime

A new series of (benzo[b]thienyl)methyl ethers of 1-(2,4-dichlorophenyl)-2-(1H-imidazol-1-yl)ethanol and of (Z)-1-(2,4-dichlorophenyl)-2-(1H-imidazol-1-yl)ethanone oxime were synthesized and tested for antifungal activity. Series design, synthesis, preliminary antimycotic data and structure-activity relationships are reported. 7-Chloro-3-[1-(2,4-dichlorophenyl)-2-(1H-imidazol-1-yl)ethoxymethyl] benzo[b]thiophene (8i, Sertaconazole, FI-7045, CAS 99592-32-2) and its nitrate were selected for further research.