N~4~-[(2H-1,3-benzodioxol-5-yl)methyl]-4-methyl-N~1~-[3-(methylsulfanyl)phenyl]piperidine-1,4-dicarboxamide
Chemical Structure Depiction of
N~4~-[(2H-1,3-benzodioxol-5-yl)methyl]-4-methyl-N~1~-[3-(methylsulfanyl)phenyl]piperidine-1,4-dicarboxamide
N~4~-[(2H-1,3-benzodioxol-5-yl)methyl]-4-methyl-N~1~-[3-(methylsulfanyl)phenyl]piperidine-1,4-dicarboxamide
Compound characteristics
| Compound ID: | F708-0557 |
| Compound Name: | N~4~-[(2H-1,3-benzodioxol-5-yl)methyl]-4-methyl-N~1~-[3-(methylsulfanyl)phenyl]piperidine-1,4-dicarboxamide |
| Molecular Weight: | 441.55 |
| Molecular Formula: | C23 H27 N3 O4 S |
| Smiles: | CC1(CCN(CC1)C(Nc1cccc(c1)SC)=O)C(NCc1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4257 |
| logD: | 3.4257 |
| logSw: | -3.7431 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.236 |
| InChI Key: | WUEMJKBTMFRYDD-UHFFFAOYSA-N |