3-(azepan-1-yl)-6-fluoro-4H-1-benzothiopyran-4-one
Chemical Structure Depiction of
3-(azepan-1-yl)-6-fluoro-4H-1-benzothiopyran-4-one
3-(azepan-1-yl)-6-fluoro-4H-1-benzothiopyran-4-one
Compound characteristics
| Compound ID: | G617-0284 |
| Compound Name: | 3-(azepan-1-yl)-6-fluoro-4H-1-benzothiopyran-4-one |
| Molecular Weight: | 277.36 |
| Molecular Formula: | C15 H16 F N O S |
| Smiles: | C1CCCN(CC1)C1=CSc2ccc(cc2C1=O)F |
| Stereo: | ACHIRAL |
| logP: | 4.1828 |
| logD: | 4.1064 |
| logSw: | -4.1508 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 16.8158 |
| InChI Key: | QLNJGZWYGNJIHB-UHFFFAOYSA-N |