N-[(4-methoxyphenyl)methyl]-2-{[3-(pyrrolidin-1-yl)quinoxalin-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-[(4-methoxyphenyl)methyl]-2-{[3-(pyrrolidin-1-yl)quinoxalin-2-yl]sulfanyl}acetamide
N-[(4-methoxyphenyl)methyl]-2-{[3-(pyrrolidin-1-yl)quinoxalin-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | 7472-0016 |
| Compound Name: | N-[(4-methoxyphenyl)methyl]-2-{[3-(pyrrolidin-1-yl)quinoxalin-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 408.52 |
| Molecular Formula: | C22 H24 N4 O2 S |
| Smiles: | COc1ccc(CNC(CSc2c(nc3ccccc3n2)N2CCCC2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.3386 |
| logD: | 4.3386 |
| logSw: | -4.1633 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.798 |
| InChI Key: | WCVKGWDQUMWRBH-UHFFFAOYSA-N |