1-{2-[4-(2,3-dimethylphenyl)piperazine-1-sulfonyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}ethan-1-one
Chemical Structure Depiction of
1-{2-[4-(2,3-dimethylphenyl)piperazine-1-sulfonyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}ethan-1-one
1-{2-[4-(2,3-dimethylphenyl)piperazine-1-sulfonyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}ethan-1-one
Compound characteristics
| Compound ID: | P025-0059 |
| Compound Name: | 1-{2-[4-(2,3-dimethylphenyl)piperazine-1-sulfonyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}ethan-1-one |
| Molecular Weight: | 433.59 |
| Molecular Formula: | C21 H27 N3 O3 S2 |
| Smiles: | CC(N1CCc2c(C1)cc(s2)S(N1CCN(CC1)c1cccc(C)c1C)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5557 |
| logD: | 3.5557 |
| logSw: | -3.8175 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.977 |
| InChI Key: | XZFOZAIQSHRTQY-UHFFFAOYSA-N |