pentyl 4-(3-bromophenyl)-2-methyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate
Chemical Structure Depiction of
pentyl 4-(3-bromophenyl)-2-methyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate
pentyl 4-(3-bromophenyl)-2-methyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate
Compound characteristics
Compound ID: | C202-0633 |
Compound Name: | pentyl 4-(3-bromophenyl)-2-methyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate |
Molecular Weight: | 454.37 |
Molecular Formula: | C23 H24 Br N3 O2 |
Smiles: | CCCCCOC(C1C(c2cccc(c2)[Br])n2c3ccccc3nc2NC=1C)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 6.6416 |
logD: | 6.63 |
logSw: | -5.4806 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 45.082 |
InChI Key: | ZXHHQGPKDZQMEL-NRFANRHFSA-N |