Back
HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 66831713Generated: October 30, 2026

5-Benzyl-N-(2-(5-chloro-1H-indol-3-yl)ethyl)isothiazole-3-carboxamide

https://huagongshe.com/en/chemical/66831713

5-Benzyl-N-(2-(5-chloro-1H-indol-3-yl)ethyl)isothiazole-3-carboxamide molecular structure

Identifiers & Physical Properties

Molecular formulaC21H18ClN3OS
Average molar mass395.9 g/mol
SMILESO=C(NCCc1c[nH]c2ccc(Cl)cc12)c1cc(Cc2ccccc2)sn1
InChIKeyRXOTWHVWTYHMJK-UHFFFAOYSA-N
PubChem CID66831713

Chemical & Physical Properties

XLogP5.3
Topological polar surface area86
Hydrogen bond donors2
Hydrogen bond acceptors3
Rotatable bonds6
Heavy atoms27
Formal charge0
Complexity502