(azepan-1-yl)[2-methoxy-4-(methylsulfanyl)phenyl]methanone
Chemical Structure Depiction of
(azepan-1-yl)[2-methoxy-4-(methylsulfanyl)phenyl]methanone
(azepan-1-yl)[2-methoxy-4-(methylsulfanyl)phenyl]methanone
Compound characteristics
| Compound ID: | Y032-1137 |
| Compound Name: | (azepan-1-yl)[2-methoxy-4-(methylsulfanyl)phenyl]methanone |
| Molecular Weight: | 279.4 |
| Molecular Formula: | C15 H21 N O2 S |
| Smiles: | COc1cc(ccc1C(N1CCCCCC1)=O)SC |
| Stereo: | ACHIRAL |
| logP: | 3.2669 |
| logD: | 3.2669 |
| logSw: | -3.4321 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 24.8481 |
| InChI Key: | CCHNNQACJOGRSX-UHFFFAOYSA-N |