2-(4-benzyl-2,3-dioxo-3,4-dihydroquinoxalin-1(2H)-yl)-N-{[4-(methylsulfanyl)phenyl]methyl}acetamide
Chemical Structure Depiction of
2-(4-benzyl-2,3-dioxo-3,4-dihydroquinoxalin-1(2H)-yl)-N-{[4-(methylsulfanyl)phenyl]methyl}acetamide
2-(4-benzyl-2,3-dioxo-3,4-dihydroquinoxalin-1(2H)-yl)-N-{[4-(methylsulfanyl)phenyl]methyl}acetamide
Compound characteristics
| Compound ID: | G761-0956 |
| Compound Name: | 2-(4-benzyl-2,3-dioxo-3,4-dihydroquinoxalin-1(2H)-yl)-N-{[4-(methylsulfanyl)phenyl]methyl}acetamide |
| Molecular Weight: | 445.54 |
| Molecular Formula: | C25 H23 N3 O3 S |
| Smiles: | CSc1ccc(CNC(CN2C(C(N(Cc3ccccc3)c3ccccc23)=O)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.895 |
| logD: | 3.895 |
| logSw: | -3.9826 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.995 |
| InChI Key: | VFMGPKYELTZMKQ-UHFFFAOYSA-N |