ethyl 1-[rel-(3R,4S)-4-(benzenesulfonyl)-1,1-dioxo-1lambda~6~-thiolan-3-yl]piperidine-4-carboxylate
Chemical Structure Depiction of
ethyl 1-[rel-(3R,4S)-4-(benzenesulfonyl)-1,1-dioxo-1lambda~6~-thiolan-3-yl]piperidine-4-carboxylate
ethyl 1-[rel-(3R,4S)-4-(benzenesulfonyl)-1,1-dioxo-1lambda~6~-thiolan-3-yl]piperidine-4-carboxylate
Compound characteristics
Compound ID: | D470-1775 |
Compound Name: | ethyl 1-[rel-(3R,4S)-4-(benzenesulfonyl)-1,1-dioxo-1lambda~6~-thiolan-3-yl]piperidine-4-carboxylate |
Molecular Weight: | 415.53 |
Molecular Formula: | C18 H25 N O6 S2 |
Smiles: | CCOC(C1CCN(CC1)[C@H]1CS(C[C@@H]1S(c1ccccc1)(=O)=O)(=O)=O)=O |
Stereo: | RACEMIC MIXTURE (RELATIVE) |
logP: | 0.7733 |
logD: | 0.7732 |
logSw: | -2.0589 |
Hydrogen bond acceptors count: | 12 |
Polar surface area: | 81.681 |
InChI Key: | ONFMSTAIYOHNTJ-IAGOWNOFSA-N |