rel-(3R,4S)-3-(benzenesulfonyl)-4-{methyl[2-(pyridin-4-yl)ethyl]amino}-1lambda~6~-thiolane-1,1-dione
Chemical Structure Depiction of
rel-(3R,4S)-3-(benzenesulfonyl)-4-{methyl[2-(pyridin-4-yl)ethyl]amino}-1lambda~6~-thiolane-1,1-dione
rel-(3R,4S)-3-(benzenesulfonyl)-4-{methyl[2-(pyridin-4-yl)ethyl]amino}-1lambda~6~-thiolane-1,1-dione
Compound characteristics
| Compound ID: | D470-1758 |
| Compound Name: | rel-(3R,4S)-3-(benzenesulfonyl)-4-{methyl[2-(pyridin-4-yl)ethyl]amino}-1lambda~6~-thiolane-1,1-dione |
| Molecular Weight: | 394.51 |
| Molecular Formula: | C18 H22 N2 O4 S2 |
| Smiles: | CN(CCc1ccncc1)[C@H]1CS(C[C@@H]1S(c1ccccc1)(=O)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.1502 |
| logD: | 0.1339 |
| logSw: | -1.6725 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 69.836 |
| InChI Key: | HEFJKBHUVGTVHD-QZTJIDSGSA-N |