rel-(3R,4S)-3-(4-methylbenzene-1-sulfonyl)-4-[(prop-2-en-1-yl)amino]-1lambda~6~-thiolane-1,1-dione
Chemical Structure Depiction of
rel-(3R,4S)-3-(4-methylbenzene-1-sulfonyl)-4-[(prop-2-en-1-yl)amino]-1lambda~6~-thiolane-1,1-dione
rel-(3R,4S)-3-(4-methylbenzene-1-sulfonyl)-4-[(prop-2-en-1-yl)amino]-1lambda~6~-thiolane-1,1-dione
Compound characteristics
| Compound ID: | D470-1806 |
| Compound Name: | rel-(3R,4S)-3-(4-methylbenzene-1-sulfonyl)-4-[(prop-2-en-1-yl)amino]-1lambda~6~-thiolane-1,1-dione |
| Molecular Weight: | 329.43 |
| Molecular Formula: | C14 H19 N O4 S2 |
| Smiles: | Cc1ccc(cc1)S([C@H]1CS(C[C@@H]1NCC=C)(=O)=O)(=O)=O |
| Stereo: | RELATIVE |
| logP: | 0.6632 |
| logD: | 0.6631 |
| logSw: | -2.0712 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.962 |
| InChI Key: | DHUQVYSNMDQJMT-ZIAGYGMSSA-N |