methyl 1-[rel-(3R,4S)-4-(4-chlorobenzene-1-sulfonyl)-1,1-dioxo-1lambda~6~-thiolan-3-yl]piperidine-4-carboxylate
Chemical Structure Depiction of
methyl 1-[rel-(3R,4S)-4-(4-chlorobenzene-1-sulfonyl)-1,1-dioxo-1lambda~6~-thiolan-3-yl]piperidine-4-carboxylate
methyl 1-[rel-(3R,4S)-4-(4-chlorobenzene-1-sulfonyl)-1,1-dioxo-1lambda~6~-thiolan-3-yl]piperidine-4-carboxylate
Compound characteristics
| Compound ID: | D470-2219 |
| Compound Name: | methyl 1-[rel-(3R,4S)-4-(4-chlorobenzene-1-sulfonyl)-1,1-dioxo-1lambda~6~-thiolan-3-yl]piperidine-4-carboxylate |
| Molecular Weight: | 435.94 |
| Molecular Formula: | C17 H22 Cl N O6 S2 |
| Smiles: | COC(C1CCN(CC1)[C@H]1CS(C[C@@H]1S(c1ccc(cc1)[Cl])(=O)=O)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.9844 |
| logD: | 0.9843 |
| logSw: | -2.5758 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 82.101 |
| InChI Key: | GDFWWUHATLKVOA-HOTGVXAUSA-N |