methyl 1-[2-(propylsulfanyl)benzoyl]piperidine-4-carboxylate
Chemical Structure Depiction of
methyl 1-[2-(propylsulfanyl)benzoyl]piperidine-4-carboxylate
methyl 1-[2-(propylsulfanyl)benzoyl]piperidine-4-carboxylate
Compound characteristics
| Compound ID: | Y031-2776 |
| Compound Name: | methyl 1-[2-(propylsulfanyl)benzoyl]piperidine-4-carboxylate |
| Molecular Weight: | 321.44 |
| Molecular Formula: | C17 H23 N O3 S |
| Smiles: | CCCSc1ccccc1C(N1CCC(CC1)C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7986 |
| logD: | 2.7986 |
| logSw: | -3.2222 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 38.061 |
| InChI Key: | CTHZWXDNIGLVAK-UHFFFAOYSA-N |