4-[(4-ethyl-2,3-dioxo-3,4-dihydropyrido[2,3-b]pyrazin-1(2H)-yl)methyl]-N-{[4-(methylsulfanyl)phenyl]methyl}benzamide
Chemical Structure Depiction of
4-[(4-ethyl-2,3-dioxo-3,4-dihydropyrido[2,3-b]pyrazin-1(2H)-yl)methyl]-N-{[4-(methylsulfanyl)phenyl]methyl}benzamide
4-[(4-ethyl-2,3-dioxo-3,4-dihydropyrido[2,3-b]pyrazin-1(2H)-yl)methyl]-N-{[4-(methylsulfanyl)phenyl]methyl}benzamide
Compound characteristics
| Compound ID: | F704-0241 |
| Compound Name: | 4-[(4-ethyl-2,3-dioxo-3,4-dihydropyrido[2,3-b]pyrazin-1(2H)-yl)methyl]-N-{[4-(methylsulfanyl)phenyl]methyl}benzamide |
| Molecular Weight: | 460.55 |
| Molecular Formula: | C25 H24 N4 O3 S |
| Smiles: | CCN1C(C(N(Cc2ccc(cc2)C(NCc2ccc(cc2)SC)=O)c2cccnc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4458 |
| logD: | 3.4457 |
| logSw: | -3.6877 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.264 |
| InChI Key: | IKDJEWKOWUAQID-UHFFFAOYSA-N |