octyl 4-(2,3-dimethoxyphenyl)-2-methyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate
Chemical Structure Depiction of
octyl 4-(2,3-dimethoxyphenyl)-2-methyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate
octyl 4-(2,3-dimethoxyphenyl)-2-methyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate
Compound characteristics
Compound ID: | C202-0789 |
Compound Name: | octyl 4-(2,3-dimethoxyphenyl)-2-methyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate |
Molecular Weight: | 477.6 |
Molecular Formula: | C28 H35 N3 O4 |
Smiles: | CCCCCCCCOC(C1C(c2cccc(c2OC)OC)n2c3ccccc3nc2NC=1C)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 7.1497 |
logD: | 7.138 |
logSw: | -5.7034 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 60.429 |
InChI Key: | CARJFGVRHXQNFK-VWLOTQADSA-N |