methyl (4-oxo-1,4-dihydropyrimido[1,2-a]benzimidazol-2-yl)acetate
Chemical Structure Depiction of
methyl (4-oxo-1,4-dihydropyrimido[1,2-a]benzimidazol-2-yl)acetate
methyl (4-oxo-1,4-dihydropyrimido[1,2-a]benzimidazol-2-yl)acetate
Compound characteristics
| Compound ID: | 8018-1527 |
| Compound Name: | methyl (4-oxo-1,4-dihydropyrimido[1,2-a]benzimidazol-2-yl)acetate |
| Molecular Weight: | 257.25 |
| Molecular Formula: | C13 H11 N3 O3 |
| Smiles: | COC(CC1=CC(n2c3ccccc3nc2N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.9829 |
| logD: | 0.7817 |
| logSw: | -1.9615 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.176 |
| InChI Key: | TYLZXQVJFHKJJB-UHFFFAOYSA-N |