2-{2,3-dioxo-4-[(pyridin-4-yl)methyl]-3,4-dihydropyrido[2,3-b]pyrazin-1(2H)-yl}-N-{[4-(methylsulfanyl)phenyl]methyl}acetamide
Chemical Structure Depiction of
2-{2,3-dioxo-4-[(pyridin-4-yl)methyl]-3,4-dihydropyrido[2,3-b]pyrazin-1(2H)-yl}-N-{[4-(methylsulfanyl)phenyl]methyl}acetamide
2-{2,3-dioxo-4-[(pyridin-4-yl)methyl]-3,4-dihydropyrido[2,3-b]pyrazin-1(2H)-yl}-N-{[4-(methylsulfanyl)phenyl]methyl}acetamide
Compound characteristics
| Compound ID: | G884-1507 |
| Compound Name: | 2-{2,3-dioxo-4-[(pyridin-4-yl)methyl]-3,4-dihydropyrido[2,3-b]pyrazin-1(2H)-yl}-N-{[4-(methylsulfanyl)phenyl]methyl}acetamide |
| Molecular Weight: | 447.51 |
| Molecular Formula: | C23 H21 N5 O3 S |
| Smiles: | CSc1ccc(CNC(CN2C(C(N(Cc3ccncc3)c3c2cccn3)=O)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 1.878 |
| logD: | 1.8772 |
| logSw: | -2.2793 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.754 |
| InChI Key: | ZIIAPJGXQUMHGQ-UHFFFAOYSA-N |