4-[(2,5-dimethoxyphenyl)methyl]-N-[3-(methylsulfanyl)phenyl]piperazine-1-carboxamide
Chemical Structure Depiction of
4-[(2,5-dimethoxyphenyl)methyl]-N-[3-(methylsulfanyl)phenyl]piperazine-1-carboxamide
4-[(2,5-dimethoxyphenyl)methyl]-N-[3-(methylsulfanyl)phenyl]piperazine-1-carboxamide
Compound characteristics
| Compound ID: | Y206-2858 |
| Compound Name: | 4-[(2,5-dimethoxyphenyl)methyl]-N-[3-(methylsulfanyl)phenyl]piperazine-1-carboxamide |
| Molecular Weight: | 401.53 |
| Molecular Formula: | C21 H27 N3 O3 S |
| Smiles: | COc1ccc(c(CN2CCN(CC2)C(Nc2cccc(c2)SC)=O)c1)OC |
| Stereo: | ACHIRAL |
| logP: | 3.3244 |
| logD: | 1.8728 |
| logSw: | -3.6254 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.422 |
| InChI Key: | CRVXBBGIPCJVAO-UHFFFAOYSA-N |