methyl 2-{2-[2-(4-methoxyphenyl)-4-oxopyrimido[1,2-a]benzimidazol-10(4H)-yl]acetamido}benzoate
Chemical Structure Depiction of
methyl 2-{2-[2-(4-methoxyphenyl)-4-oxopyrimido[1,2-a]benzimidazol-10(4H)-yl]acetamido}benzoate
methyl 2-{2-[2-(4-methoxyphenyl)-4-oxopyrimido[1,2-a]benzimidazol-10(4H)-yl]acetamido}benzoate
Compound characteristics
| Compound ID: | L218-0368 |
| Compound Name: | methyl 2-{2-[2-(4-methoxyphenyl)-4-oxopyrimido[1,2-a]benzimidazol-10(4H)-yl]acetamido}benzoate |
| Molecular Weight: | 482.5 |
| Molecular Formula: | C27 H22 N4 O5 |
| Smiles: | COC(c1ccccc1NC(CN1C2=NC(=CC(N2c2ccccc12)=O)c1ccc(cc1)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3792 |
| logD: | 3.3676 |
| logSw: | -3.7812 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.253 |
| InChI Key: | KFJHSNRXGOHIPF-UHFFFAOYSA-N |