N-(4-{[(6,7-dimethyl-3-oxo-3,4-dihydroquinoxalin-2-yl)methyl]sulfanyl}phenyl)-2-ethoxybenzamide
Chemical Structure Depiction of
N-(4-{[(6,7-dimethyl-3-oxo-3,4-dihydroquinoxalin-2-yl)methyl]sulfanyl}phenyl)-2-ethoxybenzamide
N-(4-{[(6,7-dimethyl-3-oxo-3,4-dihydroquinoxalin-2-yl)methyl]sulfanyl}phenyl)-2-ethoxybenzamide
Compound characteristics
| Compound ID: | L780-0017 |
| Compound Name: | N-(4-{[(6,7-dimethyl-3-oxo-3,4-dihydroquinoxalin-2-yl)methyl]sulfanyl}phenyl)-2-ethoxybenzamide |
| Molecular Weight: | 459.57 |
| Molecular Formula: | C26 H25 N3 O3 S |
| Smiles: | CCOc1ccccc1C(Nc1ccc(cc1)SCC1C(Nc2cc(C)c(C)cc2N=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1922 |
| logD: | 5.1894 |
| logSw: | -4.9518 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.158 |
| InChI Key: | XDPGOYGBQAYAAZ-UHFFFAOYSA-N |