N-(2,5-dimethoxyphenyl)-2-{[3-(pyrrolidin-1-yl)quinoxalin-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(2,5-dimethoxyphenyl)-2-{[3-(pyrrolidin-1-yl)quinoxalin-2-yl]sulfanyl}acetamide
N-(2,5-dimethoxyphenyl)-2-{[3-(pyrrolidin-1-yl)quinoxalin-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | 7472-0177 |
| Compound Name: | N-(2,5-dimethoxyphenyl)-2-{[3-(pyrrolidin-1-yl)quinoxalin-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 424.52 |
| Molecular Formula: | C22 H24 N4 O3 S |
| Smiles: | COc1ccc(c(c1)NC(CSc1c(nc2ccccc2n1)N1CCCC1)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 4.3584 |
| logD: | 4.3578 |
| logSw: | -4.3044 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.409 |
| InChI Key: | HRONDLJZIYCJJJ-UHFFFAOYSA-N |