N-[3-(methylsulfanyl)phenyl]-4-[(6-oxopyrido[2,3-e]pyrrolo[1,2-a]pyrazin-5(6H)-yl)methyl]benzamide
Chemical Structure Depiction of
N-[3-(methylsulfanyl)phenyl]-4-[(6-oxopyrido[2,3-e]pyrrolo[1,2-a]pyrazin-5(6H)-yl)methyl]benzamide
N-[3-(methylsulfanyl)phenyl]-4-[(6-oxopyrido[2,3-e]pyrrolo[1,2-a]pyrazin-5(6H)-yl)methyl]benzamide
Compound characteristics
| Compound ID: | E524-1638 |
| Compound Name: | N-[3-(methylsulfanyl)phenyl]-4-[(6-oxopyrido[2,3-e]pyrrolo[1,2-a]pyrazin-5(6H)-yl)methyl]benzamide |
| Molecular Weight: | 440.52 |
| Molecular Formula: | C25 H20 N4 O2 S |
| Smiles: | CSc1cccc(c1)NC(c1ccc(CN2C(c3cccn3c3cccnc23)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6131 |
| logD: | 4.6129 |
| logSw: | -4.2944 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.388 |
| InChI Key: | YSHNMAWDLLOPFR-UHFFFAOYSA-N |