6-chloro-3-(3,5-dimethylpiperidin-1-yl)-4H-1-benzothiopyran-4-one
Chemical Structure Depiction of
6-chloro-3-(3,5-dimethylpiperidin-1-yl)-4H-1-benzothiopyran-4-one
6-chloro-3-(3,5-dimethylpiperidin-1-yl)-4H-1-benzothiopyran-4-one
Compound characteristics
| Compound ID: | G856-4063 |
| Compound Name: | 6-chloro-3-(3,5-dimethylpiperidin-1-yl)-4H-1-benzothiopyran-4-one |
| Molecular Weight: | 307.84 |
| Molecular Formula: | C16 H18 Cl N O S |
| Smiles: | CC1CC(C)CN(C1)C1=CSc2ccc(cc2C1=O)[Cl] |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.9486 |
| logD: | 4.9411 |
| logSw: | -4.8768 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 16.3517 |
| InChI Key: | WAGMNCXFFLMXIP-UHFFFAOYSA-N |