rel-(3R,4S)-3-(butylamino)-4-(4-methylbenzene-1-sulfonyl)-1lambda~6~-thiolane-1,1-dione
Chemical Structure Depiction of
rel-(3R,4S)-3-(butylamino)-4-(4-methylbenzene-1-sulfonyl)-1lambda~6~-thiolane-1,1-dione
rel-(3R,4S)-3-(butylamino)-4-(4-methylbenzene-1-sulfonyl)-1lambda~6~-thiolane-1,1-dione
Compound characteristics
| Compound ID: | D470-1807 |
| Compound Name: | rel-(3R,4S)-3-(butylamino)-4-(4-methylbenzene-1-sulfonyl)-1lambda~6~-thiolane-1,1-dione |
| Molecular Weight: | 345.48 |
| Molecular Formula: | C15 H23 N O4 S2 |
| Smiles: | CCCCN[C@H]1CS(C[C@@H]1S(c1ccc(C)cc1)(=O)=O)(=O)=O |
| Stereo: | RELATIVE |
| logP: | 1.457 |
| logD: | 1.4563 |
| logSw: | -2.2589 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.962 |
| InChI Key: | ZPBJGRZMYSGQIY-HUUCEWRRSA-N |