ethyl 4-{[rel-(3R,4S)-4-(4-chlorobenzene-1-sulfonyl)-1,1-dioxo-1lambda~6~-thiolan-3-yl]amino}piperidine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-{[rel-(3R,4S)-4-(4-chlorobenzene-1-sulfonyl)-1,1-dioxo-1lambda~6~-thiolan-3-yl]amino}piperidine-1-carboxylate
ethyl 4-{[rel-(3R,4S)-4-(4-chlorobenzene-1-sulfonyl)-1,1-dioxo-1lambda~6~-thiolan-3-yl]amino}piperidine-1-carboxylate
Compound characteristics
| Compound ID: | D470-2231 |
| Compound Name: | ethyl 4-{[rel-(3R,4S)-4-(4-chlorobenzene-1-sulfonyl)-1,1-dioxo-1lambda~6~-thiolan-3-yl]amino}piperidine-1-carboxylate |
| Molecular Weight: | 464.99 |
| Molecular Formula: | C18 H25 Cl N2 O6 S2 |
| Smiles: | CCOC(N1CCC(CC1)N[C@H]1CS(C[C@@H]1S(c1ccc(cc1)[Cl])(=O)=O)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.6268 |
| logD: | 1.6235 |
| logSw: | -2.8476 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 92.354 |
| InChI Key: | RVYUFSCHFZUTOA-IRXDYDNUSA-N |