rel-(3R,4S)-3-(benzenesulfonyl)-4-{[2-(1H-indol-3-yl)ethyl]amino}-1lambda~6~-thiolane-1,1-dione
Chemical Structure Depiction of
rel-(3R,4S)-3-(benzenesulfonyl)-4-{[2-(1H-indol-3-yl)ethyl]amino}-1lambda~6~-thiolane-1,1-dione
rel-(3R,4S)-3-(benzenesulfonyl)-4-{[2-(1H-indol-3-yl)ethyl]amino}-1lambda~6~-thiolane-1,1-dione
Compound characteristics
| Compound ID: | D470-1765 |
| Compound Name: | rel-(3R,4S)-3-(benzenesulfonyl)-4-{[2-(1H-indol-3-yl)ethyl]amino}-1lambda~6~-thiolane-1,1-dione |
| Molecular Weight: | 418.53 |
| Molecular Formula: | C20 H22 N2 O4 S2 |
| Smiles: | C(CN[C@H]1CS(C[C@@H]1S(c1ccccc1)(=O)=O)(=O)=O)c1c[nH]c2ccccc12 |
| Stereo: | RELATIVE |
| logP: | 1.2728 |
| logD: | 1.2727 |
| logSw: | -2.1142 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.561 |
| InChI Key: | VSRPMKJRWLLFOQ-WOJBJXKFSA-N |