N-[1-(2,5-dimethoxyphenyl)ethyl]-1-{3-[(4-methylphenyl)sulfanyl]pyrazin-2-yl}piperidine-3-carboxamide
Chemical Structure Depiction of
N-[1-(2,5-dimethoxyphenyl)ethyl]-1-{3-[(4-methylphenyl)sulfanyl]pyrazin-2-yl}piperidine-3-carboxamide
N-[1-(2,5-dimethoxyphenyl)ethyl]-1-{3-[(4-methylphenyl)sulfanyl]pyrazin-2-yl}piperidine-3-carboxamide
Compound characteristics
| Compound ID: | L895-0165 |
| Compound Name: | N-[1-(2,5-dimethoxyphenyl)ethyl]-1-{3-[(4-methylphenyl)sulfanyl]pyrazin-2-yl}piperidine-3-carboxamide |
| Molecular Weight: | 492.64 |
| Molecular Formula: | C27 H32 N4 O3 S |
| Smiles: | CC(c1cc(ccc1OC)OC)NC(C1CCCN(C1)c1c(nccn1)Sc1ccc(C)cc1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.9882 |
| logD: | 4.9882 |
| logSw: | -4.6513 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.264 |
| InChI Key: | NJIOBBNGTTWTFK-UHFFFAOYSA-N |