6-bromo-3-(3-methylpiperidin-1-yl)-4H-1-benzothiopyran-4-one
Chemical Structure Depiction of
6-bromo-3-(3-methylpiperidin-1-yl)-4H-1-benzothiopyran-4-one
6-bromo-3-(3-methylpiperidin-1-yl)-4H-1-benzothiopyran-4-one
Compound characteristics
| Compound ID: | G617-0313 |
| Compound Name: | 6-bromo-3-(3-methylpiperidin-1-yl)-4H-1-benzothiopyran-4-one |
| Molecular Weight: | 338.26 |
| Molecular Formula: | C15 H16 Br N O S |
| Smiles: | CC1CCCN(C1)C1=CSc2ccc(cc2C1=O)[Br] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5777 |
| logD: | 4.5697 |
| logSw: | -4.2813 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 16.4182 |
| InChI Key: | CETUVJFKNMQUMB-JTQLQIEISA-N |