N-{[4-(methylsulfanyl)phenyl]methyl}-4-[(6-oxopyrido[2,3-e]pyrrolo[1,2-a]pyrazin-5(6H)-yl)methyl]benzamide
Chemical Structure Depiction of
N-{[4-(methylsulfanyl)phenyl]methyl}-4-[(6-oxopyrido[2,3-e]pyrrolo[1,2-a]pyrazin-5(6H)-yl)methyl]benzamide
N-{[4-(methylsulfanyl)phenyl]methyl}-4-[(6-oxopyrido[2,3-e]pyrrolo[1,2-a]pyrazin-5(6H)-yl)methyl]benzamide
Compound characteristics
| Compound ID: | E524-1753 |
| Compound Name: | N-{[4-(methylsulfanyl)phenyl]methyl}-4-[(6-oxopyrido[2,3-e]pyrrolo[1,2-a]pyrazin-5(6H)-yl)methyl]benzamide |
| Molecular Weight: | 454.55 |
| Molecular Formula: | C26 H22 N4 O2 S |
| Smiles: | CSc1ccc(CNC(c2ccc(CN3C(c4cccn4c4cccnc34)=O)cc2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.5373 |
| logD: | 4.5373 |
| logSw: | -4.1879 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.71 |
| InChI Key: | BYHKYOYGTOGOSA-UHFFFAOYSA-N |