rel-(3R,4S)-3-(4-fluoro-3-methylbenzene-1-sulfonyl)-4-{[(pyridin-3-yl)methyl]amino}-1lambda~6~-thiolane-1,1-dione
Chemical Structure Depiction of
rel-(3R,4S)-3-(4-fluoro-3-methylbenzene-1-sulfonyl)-4-{[(pyridin-3-yl)methyl]amino}-1lambda~6~-thiolane-1,1-dione
rel-(3R,4S)-3-(4-fluoro-3-methylbenzene-1-sulfonyl)-4-{[(pyridin-3-yl)methyl]amino}-1lambda~6~-thiolane-1,1-dione
Compound characteristics
| Compound ID: | D470-2112 |
| Compound Name: | rel-(3R,4S)-3-(4-fluoro-3-methylbenzene-1-sulfonyl)-4-{[(pyridin-3-yl)methyl]amino}-1lambda~6~-thiolane-1,1-dione |
| Molecular Weight: | 398.47 |
| Molecular Formula: | C17 H19 F N2 O4 S2 |
| Smiles: | Cc1cc(ccc1F)S([C@H]1CS(C[C@@H]1NCc1cccnc1)(=O)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.1049 |
| logD: | 0.1042 |
| logSw: | -1.8261 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.366 |
| InChI Key: | SKIDROJLVSJUSA-IAGOWNOFSA-N |