1-(azepan-1-yl)-2-{[3-(4-methylpiperidin-1-yl)quinoxalin-2-yl]sulfanyl}ethan-1-one
Chemical Structure Depiction of
1-(azepan-1-yl)-2-{[3-(4-methylpiperidin-1-yl)quinoxalin-2-yl]sulfanyl}ethan-1-one
1-(azepan-1-yl)-2-{[3-(4-methylpiperidin-1-yl)quinoxalin-2-yl]sulfanyl}ethan-1-one
Compound characteristics
| Compound ID: | 7472-0229 |
| Compound Name: | 1-(azepan-1-yl)-2-{[3-(4-methylpiperidin-1-yl)quinoxalin-2-yl]sulfanyl}ethan-1-one |
| Molecular Weight: | 398.57 |
| Molecular Formula: | C22 H30 N4 O S |
| Smiles: | CC1CCN(CC1)c1c(nc2ccccc2n1)SCC(N1CCCCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1807 |
| logD: | 5.1807 |
| logSw: | -4.849 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.14 |
| InChI Key: | BZCCWZUMUWUYJZ-UHFFFAOYSA-N |