3-(azepan-1-yl)-6-chloro-4H-1-benzothiopyran-4-one
Chemical Structure Depiction of
3-(azepan-1-yl)-6-chloro-4H-1-benzothiopyran-4-one
3-(azepan-1-yl)-6-chloro-4H-1-benzothiopyran-4-one
Compound characteristics
| Compound ID: | G617-0170 |
| Compound Name: | 3-(azepan-1-yl)-6-chloro-4H-1-benzothiopyran-4-one |
| Molecular Weight: | 293.81 |
| Molecular Formula: | C15 H16 Cl N O S |
| Smiles: | C1CCCN(CC1)C1=CSc2ccc(cc2C1=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.6382 |
| logD: | 4.5835 |
| logSw: | -4.8264 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 16.8158 |
| InChI Key: | LWYBJQIKAIYMAB-UHFFFAOYSA-N |