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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 5259171Generated: November 4, 2026

1-(5-{[(2-Fluorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-hydroxy-5-(3-hydroxyphenyl)-4-(7-methoxy-1-benzofuran-2-carbonyl)-1,5-dihydro-2H-pyrrol-2-one

2-CHLOROETHYLPYRROLIDINE HCL · 1-(2-CHLOROETHYL)PYRROLIDINE HCL · N-(BETA-CHLOROETHYL)PYRROLIDINE HCL · 2-CHLOROETHYLPYRROLIDINE HYDROCHLORIDE · PYRROLIDINOETHYL CHLORIDE HYDROCHLORIDE · PYRROLIDINE, 1-(2-CHLOROETHYL)-, HYDROCHLORIDE

https://huagongshe.com/en/chemical/5259171

1-(5-{[(2-Fluorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-hydroxy-5-(3-hydroxyphenyl)-4-(7-methoxy-1-benzofuran-2-carbonyl)-1,5-dihydro-2H-pyrrol-2-one molecular structure

Identifiers & Physical Properties

CAS No.7050-67-1
Molecular formulaC29H20FN3O6S2
Average molar mass589.6 g/mol
Monoisotopic mass589.07775588 g/mol
SMILESCOc1cccc2cc(C(=O)C3=C(O)C(=O)N(c4nnc(SCc5ccccc5F)s4)C3c3cccc(O)c3)oc12
InChIKeyXJJAZMPLAJPWKR-UHFFFAOYSA-N
PubChem CID5259171
DTXSIDDTXSID50990705

Chemical & Physical Properties

XLogP6.1
Topological polar surface area180
Hydrogen bond donors2
Hydrogen bond acceptors11
Rotatable bonds8
Heavy atoms41
Formal charge0
Complexity1,020
Melting point167-170 °C(lit.)
CAS DataBase Reference7050-67-1(CAS DataBase Reference)
EWG's Food Scores1
Hazard symbolsXi
Risk statements (R)36/37/38
Safety statements (S)26-36
Water hazard class (WGK)3
RTECS numberUY0703150

Safety & Regulations

Water hazard class (WGK)3
RTECS numberUY0703150
Risk statements (R)36/37/38
Hazard symbolsXi
Safety statements (S)26-36