8-[4-(pyridin-2-yl)piperazine-1-carbonyl]-2,3-dihydro-4H-1-benzothiopyran-4-one
Chemical Structure Depiction of
8-[4-(pyridin-2-yl)piperazine-1-carbonyl]-2,3-dihydro-4H-1-benzothiopyran-4-one
8-[4-(pyridin-2-yl)piperazine-1-carbonyl]-2,3-dihydro-4H-1-benzothiopyran-4-one
Compound characteristics
| Compound ID: | G777-0068 |
| Compound Name: | 8-[4-(pyridin-2-yl)piperazine-1-carbonyl]-2,3-dihydro-4H-1-benzothiopyran-4-one |
| Molecular Weight: | 353.44 |
| Molecular Formula: | C19 H19 N3 O2 S |
| Smiles: | C1CSc2c(cccc2C(N2CCN(CC2)c2ccccn2)=O)C1=O |
| Stereo: | ACHIRAL |
| logP: | 2.5562 |
| logD: | 2.5473 |
| logSw: | -2.8948 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.827 |
| InChI Key: | PSCFXAQKHMTXCP-UHFFFAOYSA-N |