methyl 1-[2-methoxy-4-(methylsulfanyl)benzoyl]piperidine-4-carboxylate
Chemical Structure Depiction of
methyl 1-[2-methoxy-4-(methylsulfanyl)benzoyl]piperidine-4-carboxylate
methyl 1-[2-methoxy-4-(methylsulfanyl)benzoyl]piperidine-4-carboxylate
Compound characteristics
| Compound ID: | Y030-5632 |
| Compound Name: | methyl 1-[2-methoxy-4-(methylsulfanyl)benzoyl]piperidine-4-carboxylate |
| Molecular Weight: | 323.41 |
| Molecular Formula: | C16 H21 N O4 S |
| Smiles: | COC(C1CCN(CC1)C(c1ccc(cc1OC)SC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1149 |
| logD: | 2.1149 |
| logSw: | -2.8582 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 45.691 |
| InChI Key: | OONKAINUTNLVKD-UHFFFAOYSA-N |