Structure via PubChem · Public domain (PubChem)
Chemical data
- Formula
- C22H28ClNO
- Molecular weight
- 357.9 g/mol
- IUPAC name
- 1-[2-[1-(4-chlorophenyl)-1-phenylethoxy]ethyl]azepane
- SMILES
- CC(C1=CC=CC=C1)(C2=CC=C(C=C2)Cl)OCCN3CCCCCC3
- InChIKey
- VBSPHZOBAOWFCL-UHFFFAOYSA-N
- XLogP
- 5.3
- Polar surface area
- 12.5 Ų
- H-bond donors
- 0
- H-bond acceptors
- 2
- Formal charge
- 0
via PubChem
Drug data · ChEMBL
- Max clinical phase
- Phase 2
- Molecule type
- Small molecule
via ChEMBL · EBI
Wikidata facts
- Subclass of
- chemical compound
- Mass
- 357.186
Show 3 more facts
- chemical formula
- C₂₂H₂₈ClNO
- canonical SMILES
- CC(C1=CC=CC=C1)(C2=CC=C(C=C2)Cl)OCCN3CCCCCC3
- Commons category
- Setastine
Sources (2)
via Wikidata · CC0