N-(4-{[(6,7-dimethyl-3-oxo-3,4-dihydroquinoxalin-2-yl)methyl]sulfanyl}phenyl)-4-ethylbenzamide
Chemical Structure Depiction of
N-(4-{[(6,7-dimethyl-3-oxo-3,4-dihydroquinoxalin-2-yl)methyl]sulfanyl}phenyl)-4-ethylbenzamide
N-(4-{[(6,7-dimethyl-3-oxo-3,4-dihydroquinoxalin-2-yl)methyl]sulfanyl}phenyl)-4-ethylbenzamide
Compound characteristics
| Compound ID: | L150-0825 |
| Compound Name: | N-(4-{[(6,7-dimethyl-3-oxo-3,4-dihydroquinoxalin-2-yl)methyl]sulfanyl}phenyl)-4-ethylbenzamide |
| Molecular Weight: | 443.57 |
| Molecular Formula: | C26 H25 N3 O2 S |
| Smiles: | CCc1ccc(cc1)C(Nc1ccc(cc1)SCC1C(Nc2cc(C)c(C)cc2N=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.844 |
| logD: | 5.8438 |
| logSw: | -5.42 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.948 |
| InChI Key: | GFMNHJIUQVORQR-UHFFFAOYSA-N |