methyl 1-[rel-(3R,4S)-4-(4-acetamidobenzene-1-sulfonyl)-1,1-dioxo-1lambda~6~-thiolan-3-yl]piperidine-4-carboxylate
Chemical Structure Depiction of
methyl 1-[rel-(3R,4S)-4-(4-acetamidobenzene-1-sulfonyl)-1,1-dioxo-1lambda~6~-thiolan-3-yl]piperidine-4-carboxylate
methyl 1-[rel-(3R,4S)-4-(4-acetamidobenzene-1-sulfonyl)-1,1-dioxo-1lambda~6~-thiolan-3-yl]piperidine-4-carboxylate
Compound characteristics
| Compound ID: | D470-2401 |
| Compound Name: | methyl 1-[rel-(3R,4S)-4-(4-acetamidobenzene-1-sulfonyl)-1,1-dioxo-1lambda~6~-thiolan-3-yl]piperidine-4-carboxylate |
| Molecular Weight: | 458.55 |
| Molecular Formula: | C19 H26 N2 O7 S2 |
| Smiles: | CC(Nc1ccc(cc1)S([C@H]1CS(C[C@@H]1N1CCC(CC1)C(=O)OC)(=O)=O)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | -0.4091 |
| logD: | -0.4093 |
| logSw: | -2.0641 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 105.363 |
| InChI Key: | HLXKLCCIBSLTSH-QZTJIDSGSA-N |