heptyl 4-(5-bromo-2-fluorophenyl)-2-methyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate
Chemical Structure Depiction of
heptyl 4-(5-bromo-2-fluorophenyl)-2-methyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate
heptyl 4-(5-bromo-2-fluorophenyl)-2-methyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate
Compound characteristics
| Compound ID: | C202-0625 |
| Compound Name: | heptyl 4-(5-bromo-2-fluorophenyl)-2-methyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate |
| Molecular Weight: | 500.41 |
| Molecular Formula: | C25 H27 Br F N3 O2 |
| Smiles: | CCCCCCCOC(C1C(c2cc(ccc2F)[Br])n2c3ccccc3nc2NC=1C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.8038 |
| logD: | 7.7957 |
| logSw: | -5.62 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.082 |
| InChI Key: | LUMVWSDJVHLDDO-QHCPKHFHSA-N |