rel-(3R,4S)-3-(4-methylbenzene-1-sulfonyl)-4-[(3-methylbutyl)amino]-1lambda~6~-thiolane-1,1-dione
Chemical Structure Depiction of
rel-(3R,4S)-3-(4-methylbenzene-1-sulfonyl)-4-[(3-methylbutyl)amino]-1lambda~6~-thiolane-1,1-dione
rel-(3R,4S)-3-(4-methylbenzene-1-sulfonyl)-4-[(3-methylbutyl)amino]-1lambda~6~-thiolane-1,1-dione
Compound characteristics
| Compound ID: | D470-1891 |
| Compound Name: | rel-(3R,4S)-3-(4-methylbenzene-1-sulfonyl)-4-[(3-methylbutyl)amino]-1lambda~6~-thiolane-1,1-dione |
| Molecular Weight: | 359.5 |
| Molecular Formula: | C16 H25 N O4 S2 |
| Smiles: | CC(C)CCN[C@H]1CS(C[C@@H]1S(c1ccc(C)cc1)(=O)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.762 |
| logD: | 1.7614 |
| logSw: | -2.4338 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.962 |
| InChI Key: | UPSOXDPTIIXTHT-HZPDHXFCSA-N |