rel-(3R,4S)-3-{[(2-fluorophenyl)methyl]amino}-4-(4-methoxybenzene-1-sulfonyl)-1lambda~6~-thiolane-1,1-dione
Chemical Structure Depiction of
rel-(3R,4S)-3-{[(2-fluorophenyl)methyl]amino}-4-(4-methoxybenzene-1-sulfonyl)-1lambda~6~-thiolane-1,1-dione
rel-(3R,4S)-3-{[(2-fluorophenyl)methyl]amino}-4-(4-methoxybenzene-1-sulfonyl)-1lambda~6~-thiolane-1,1-dione
Compound characteristics
| Compound ID: | D470-2012 |
| Compound Name: | rel-(3R,4S)-3-{[(2-fluorophenyl)methyl]amino}-4-(4-methoxybenzene-1-sulfonyl)-1lambda~6~-thiolane-1,1-dione |
| Molecular Weight: | 413.49 |
| Molecular Formula: | C18 H20 F N O5 S2 |
| Smiles: | COc1ccc(cc1)S([C@H]1CS(C[C@@H]1NCc1ccccc1F)(=O)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.4113 |
| logD: | 1.4113 |
| logSw: | -2.128 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.392 |
| InChI Key: | YIXIDTUUDBWDTR-QZTJIDSGSA-N |