ethyl 1-{3-[(4-methylphenyl)sulfanyl]propanoyl}piperidine-3-carboxylate
Chemical Structure Depiction of
ethyl 1-{3-[(4-methylphenyl)sulfanyl]propanoyl}piperidine-3-carboxylate
ethyl 1-{3-[(4-methylphenyl)sulfanyl]propanoyl}piperidine-3-carboxylate
Compound characteristics
| Compound ID: | Y031-3583 |
| Compound Name: | ethyl 1-{3-[(4-methylphenyl)sulfanyl]propanoyl}piperidine-3-carboxylate |
| Molecular Weight: | 335.46 |
| Molecular Formula: | C18 H25 N O3 S |
| Smiles: | CCOC(C1CCCN(C1)C(CCSc1ccc(C)cc1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3488 |
| logD: | 3.3488 |
| logSw: | -3.3364 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 37.046 |
| InChI Key: | XBLTVHROAWSUBD-HNNXBMFYSA-N |