4-[(4-ethyl-2,3-dioxo-3,4-dihydroquinoxalin-1(2H)-yl)methyl]-N-(2-{[(furan-2-yl)methyl]sulfanyl}ethyl)benzamide
Chemical Structure Depiction of
4-[(4-ethyl-2,3-dioxo-3,4-dihydroquinoxalin-1(2H)-yl)methyl]-N-(2-{[(furan-2-yl)methyl]sulfanyl}ethyl)benzamide
4-[(4-ethyl-2,3-dioxo-3,4-dihydroquinoxalin-1(2H)-yl)methyl]-N-(2-{[(furan-2-yl)methyl]sulfanyl}ethyl)benzamide
Compound characteristics
| Compound ID: | L059-0172 |
| Compound Name: | 4-[(4-ethyl-2,3-dioxo-3,4-dihydroquinoxalin-1(2H)-yl)methyl]-N-(2-{[(furan-2-yl)methyl]sulfanyl}ethyl)benzamide |
| Molecular Weight: | 463.55 |
| Molecular Formula: | C25 H25 N3 O4 S |
| Smiles: | CCN1C(C(N(Cc2ccc(cc2)C(NCCSCc2ccco2)=O)c2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4516 |
| logD: | 3.4516 |
| logSw: | -3.7061 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.523 |
| InChI Key: | DPJJSTTYFZGEPN-UHFFFAOYSA-N |