methyl 4-{2-[4-oxo-2-(pyridin-4-yl)pyrimido[1,2-a]benzimidazol-10(4H)-yl]acetamido}benzoate
Chemical Structure Depiction of
methyl 4-{2-[4-oxo-2-(pyridin-4-yl)pyrimido[1,2-a]benzimidazol-10(4H)-yl]acetamido}benzoate
methyl 4-{2-[4-oxo-2-(pyridin-4-yl)pyrimido[1,2-a]benzimidazol-10(4H)-yl]acetamido}benzoate
Compound characteristics
| Compound ID: | L218-0347 |
| Compound Name: | methyl 4-{2-[4-oxo-2-(pyridin-4-yl)pyrimido[1,2-a]benzimidazol-10(4H)-yl]acetamido}benzoate |
| Molecular Weight: | 453.46 |
| Molecular Formula: | C25 H19 N5 O4 |
| Smiles: | COC(c1ccc(cc1)NC(CN1C2=NC(=CC(N2c2ccccc12)=O)c1ccncc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5139 |
| logD: | 2.5138 |
| logSw: | -2.5947 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.836 |
| InChI Key: | JARBQQHCGMPLDA-UHFFFAOYSA-N |