rel-(3R,4S)-3-(4-fluorobenzene-1-sulfonyl)-4-{methyl[2-(pyridin-4-yl)ethyl]amino}-1lambda~6~-thiolane-1,1-dione
Chemical Structure Depiction of
rel-(3R,4S)-3-(4-fluorobenzene-1-sulfonyl)-4-{methyl[2-(pyridin-4-yl)ethyl]amino}-1lambda~6~-thiolane-1,1-dione
rel-(3R,4S)-3-(4-fluorobenzene-1-sulfonyl)-4-{methyl[2-(pyridin-4-yl)ethyl]amino}-1lambda~6~-thiolane-1,1-dione
Compound characteristics
| Compound ID: | D470-1940 |
| Compound Name: | rel-(3R,4S)-3-(4-fluorobenzene-1-sulfonyl)-4-{methyl[2-(pyridin-4-yl)ethyl]amino}-1lambda~6~-thiolane-1,1-dione |
| Molecular Weight: | 412.5 |
| Molecular Formula: | C18 H21 F N2 O4 S2 |
| Smiles: | CN(CCc1ccncc1)[C@H]1CS(C[C@@H]1S(c1ccc(cc1)F)(=O)=O)(=O)=O |
| Stereo: | RELATIVE |
| logP: | 0.3643 |
| logD: | 0.348 |
| logSw: | -1.9278 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 69.836 |
| InChI Key: | JBFXSTWTPPTSEA-QZTJIDSGSA-N |