ethyl 4-{1-[(2-methylphenyl)methanesulfonyl]piperidine-4-carbonyl}piperazine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-{1-[(2-methylphenyl)methanesulfonyl]piperidine-4-carbonyl}piperazine-1-carboxylate
ethyl 4-{1-[(2-methylphenyl)methanesulfonyl]piperidine-4-carbonyl}piperazine-1-carboxylate
Compound characteristics
| Compound ID: | D356-0534 |
| Compound Name: | ethyl 4-{1-[(2-methylphenyl)methanesulfonyl]piperidine-4-carbonyl}piperazine-1-carboxylate |
| Molecular Weight: | 437.56 |
| Molecular Formula: | C21 H31 N3 O5 S |
| Smiles: | CCOC(N1CCN(CC1)C(C1CCN(CC1)S(Cc1ccccc1C)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4851 |
| logD: | 2.4851 |
| logSw: | -2.4323 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 71.272 |
| InChI Key: | ZXUMMDZNQJHJAQ-UHFFFAOYSA-N |