(3R*,4S*)-3-(4-methoxybenzene-1-sulfonyl)-4-{4-[(2E)-3-phenylprop-2-en-1-yl]piperazin-1-yl}-1lambda~6~-thiolane-1,1-dione
Chemical Structure Depiction of
(3R*,4S*)-3-(4-methoxybenzene-1-sulfonyl)-4-{4-[(2E)-3-phenylprop-2-en-1-yl]piperazin-1-yl}-1lambda~6~-thiolane-1,1-dione
(3R*,4S*)-3-(4-methoxybenzene-1-sulfonyl)-4-{4-[(2E)-3-phenylprop-2-en-1-yl]piperazin-1-yl}-1lambda~6~-thiolane-1,1-dione
Compound characteristics
| Compound ID: | D470-2057 |
| Compound Name: | (3R*,4S*)-3-(4-methoxybenzene-1-sulfonyl)-4-{4-[(2E)-3-phenylprop-2-en-1-yl]piperazin-1-yl}-1lambda~6~-thiolane-1,1-dione |
| Molecular Weight: | 490.64 |
| Molecular Formula: | C24 H30 N2 O5 S2 |
| Smiles: | COc1ccc(cc1)S([C@H]1CS(C[C@@H]1N1CCN(CC1)C/C=C/c1ccccc1)(=O)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.1756 |
| logD: | 2.1733 |
| logSw: | -2.3953 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 71.99 |
| InChI Key: | OFOOZVIJGOEVMO-DNQXCXABSA-N |