rel-(3R,4S)-3-(4-fluoro-3-methylbenzene-1-sulfonyl)-4-[(3-methoxypropyl)amino]-1lambda~6~-thiolane-1,1-dione
Chemical Structure Depiction of
rel-(3R,4S)-3-(4-fluoro-3-methylbenzene-1-sulfonyl)-4-[(3-methoxypropyl)amino]-1lambda~6~-thiolane-1,1-dione
rel-(3R,4S)-3-(4-fluoro-3-methylbenzene-1-sulfonyl)-4-[(3-methoxypropyl)amino]-1lambda~6~-thiolane-1,1-dione
Compound characteristics
| Compound ID: | D470-2090 |
| Compound Name: | rel-(3R,4S)-3-(4-fluoro-3-methylbenzene-1-sulfonyl)-4-[(3-methoxypropyl)amino]-1lambda~6~-thiolane-1,1-dione |
| Molecular Weight: | 379.47 |
| Molecular Formula: | C15 H22 F N O5 S2 |
| Smiles: | Cc1cc(ccc1F)S([C@H]1CS(C[C@@H]1NCCCOC)(=O)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.3045 |
| logD: | 0.3042 |
| logSw: | -2.1151 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.304 |
| InChI Key: | YUUKLNGVDUQCOC-HUUCEWRRSA-N |