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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 856421Generated: October 28, 2026

2-(Azepan-1-yl)-1-(10H-phenothiazin-10-yl)ethanone

https://huagongshe.com/en/chemical/856421

2-(Azepan-1-yl)-1-(10H-phenothiazin-10-yl)ethanone molecular structure

Identifiers & Physical Properties

CAS No.80820-34-4
Molecular formulaC20H22N2OS
Average molar mass338.5 g/mol
Monoisotopic mass338.1452845 g/mol
SMILESO=C(CN1CCCCCC1)N1c2ccccc2Sc2ccccc21
InChIKeyAFMMLOHZMBEPQA-UHFFFAOYSA-N
PubChem CID856421
ChEMBLCHEMBL1309609
DTXSIDDTXSID301352423

Chemical & Physical Properties

XLogP4.3
Topological polar surface area48.9
Hydrogen bond donors0
Hydrogen bond acceptors3
Rotatable bonds2
Heavy atoms24
Formal charge0
Complexity413