methyl 2-{4-[(6-oxopyrido[2,3-e]pyrrolo[1,2-a]pyrazin-5(6H)-yl)methyl]benzamido}benzoate
Chemical Structure Depiction of
methyl 2-{4-[(6-oxopyrido[2,3-e]pyrrolo[1,2-a]pyrazin-5(6H)-yl)methyl]benzamido}benzoate
methyl 2-{4-[(6-oxopyrido[2,3-e]pyrrolo[1,2-a]pyrazin-5(6H)-yl)methyl]benzamido}benzoate
Compound characteristics
| Compound ID: | E524-1598 |
| Compound Name: | methyl 2-{4-[(6-oxopyrido[2,3-e]pyrrolo[1,2-a]pyrazin-5(6H)-yl)methyl]benzamido}benzoate |
| Molecular Weight: | 452.47 |
| Molecular Formula: | C26 H20 N4 O4 |
| Smiles: | COC(c1ccccc1NC(c1ccc(CN2C(c3cccn3c3cccnc23)=O)cc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0749 |
| logD: | 3.6645 |
| logSw: | -4.259 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.864 |
| InChI Key: | MPCZYJJGKBPVRK-UHFFFAOYSA-N |