rel-(3R,4S)-3-(4-methoxybenzene-1-sulfonyl)-4-{[(pyridin-3-yl)methyl]amino}-1lambda~6~-thiolane-1,1-dione
Chemical Structure Depiction of
rel-(3R,4S)-3-(4-methoxybenzene-1-sulfonyl)-4-{[(pyridin-3-yl)methyl]amino}-1lambda~6~-thiolane-1,1-dione
rel-(3R,4S)-3-(4-methoxybenzene-1-sulfonyl)-4-{[(pyridin-3-yl)methyl]amino}-1lambda~6~-thiolane-1,1-dione
Compound characteristics
| Compound ID: | D470-2021 |
| Compound Name: | rel-(3R,4S)-3-(4-methoxybenzene-1-sulfonyl)-4-{[(pyridin-3-yl)methyl]amino}-1lambda~6~-thiolane-1,1-dione |
| Molecular Weight: | 396.48 |
| Molecular Formula: | C17 H20 N2 O5 S2 |
| Smiles: | COc1ccc(cc1)S([C@H]1CS(C[C@@H]1NCc1cccnc1)(=O)=O)(=O)=O |
| Stereo: | RELATIVE |
| logP: | -0.3038 |
| logD: | -0.3044 |
| logSw: | -1.605 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.91 |
| InChI Key: | VXDNBJXURUBNTR-IAGOWNOFSA-N |