2-{4-[(4-methylphenyl)methyl]-2,3-dioxo-3,4-dihydropyrido[2,3-b]pyrazin-1(2H)-yl}-N-{[4-(methylsulfanyl)phenyl]methyl}acetamide
Chemical Structure Depiction of
2-{4-[(4-methylphenyl)methyl]-2,3-dioxo-3,4-dihydropyrido[2,3-b]pyrazin-1(2H)-yl}-N-{[4-(methylsulfanyl)phenyl]methyl}acetamide
2-{4-[(4-methylphenyl)methyl]-2,3-dioxo-3,4-dihydropyrido[2,3-b]pyrazin-1(2H)-yl}-N-{[4-(methylsulfanyl)phenyl]methyl}acetamide
Compound characteristics
| Compound ID: | G884-1218 |
| Compound Name: | 2-{4-[(4-methylphenyl)methyl]-2,3-dioxo-3,4-dihydropyrido[2,3-b]pyrazin-1(2H)-yl}-N-{[4-(methylsulfanyl)phenyl]methyl}acetamide |
| Molecular Weight: | 460.55 |
| Molecular Formula: | C25 H24 N4 O3 S |
| Smiles: | Cc1ccc(CN2C(C(N(CC(NCc3ccc(cc3)SC)=O)c3cccnc23)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.6579 |
| logD: | 3.6579 |
| logSw: | -3.7924 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.326 |
| InChI Key: | VRUIVVJSDZRGLL-UHFFFAOYSA-N |