ethyl 1-{5-[(benzenesulfinyl)methyl]furan-2-carbonyl}piperidine-3-carboxylate
Chemical Structure Depiction of
ethyl 1-{5-[(benzenesulfinyl)methyl]furan-2-carbonyl}piperidine-3-carboxylate
ethyl 1-{5-[(benzenesulfinyl)methyl]furan-2-carbonyl}piperidine-3-carboxylate
Compound characteristics
| Compound ID: | C520-0026 |
| Compound Name: | ethyl 1-{5-[(benzenesulfinyl)methyl]furan-2-carbonyl}piperidine-3-carboxylate |
| Molecular Weight: | 389.47 |
| Molecular Formula: | C20 H23 N O5 S |
| Smiles: | CCOC(C1CCCN(C1)C(c1ccc(CS(c2ccccc2)=O)o1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7196 |
| logD: | 2.7196 |
| logSw: | -2.9759 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 60.556 |
| InChI Key: | QNKHYRDGHQUNAH-UHFFFAOYSA-N |