N-[(2-methoxyphenyl)methyl]-2-{[3-(pyrrolidin-1-yl)quinoxalin-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-[(2-methoxyphenyl)methyl]-2-{[3-(pyrrolidin-1-yl)quinoxalin-2-yl]sulfanyl}acetamide
N-[(2-methoxyphenyl)methyl]-2-{[3-(pyrrolidin-1-yl)quinoxalin-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | 7472-0029 |
| Compound Name: | N-[(2-methoxyphenyl)methyl]-2-{[3-(pyrrolidin-1-yl)quinoxalin-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 408.52 |
| Molecular Formula: | C22 H24 N4 O2 S |
| Smiles: | COc1ccccc1CNC(CSc1c(nc2ccccc2n1)N1CCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5776 |
| logD: | 4.5776 |
| logSw: | -4.3347 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.885 |
| InChI Key: | GBAIVDWSONZUPL-UHFFFAOYSA-N |