dimethyl 5-{[1-(phenylmethanesulfonyl)piperidine-4-carbonyl]amino}benzene-1,3-dicarboxylate
Chemical Structure Depiction of
dimethyl 5-{[1-(phenylmethanesulfonyl)piperidine-4-carbonyl]amino}benzene-1,3-dicarboxylate
dimethyl 5-{[1-(phenylmethanesulfonyl)piperidine-4-carbonyl]amino}benzene-1,3-dicarboxylate
Compound characteristics
| Compound ID: | D356-0446 |
| Compound Name: | dimethyl 5-{[1-(phenylmethanesulfonyl)piperidine-4-carbonyl]amino}benzene-1,3-dicarboxylate |
| Molecular Weight: | 474.53 |
| Molecular Formula: | C23 H26 N2 O7 S |
| Smiles: | COC(c1cc(cc(c1)NC(C1CCN(CC1)S(Cc1ccccc1)(=O)=O)=O)C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8345 |
| logD: | 2.8344 |
| logSw: | -3.4485 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 97.283 |
| InChI Key: | UMJFKNUAMDUZDZ-UHFFFAOYSA-N |