ethyl 2-{[(2-bromo-5-fluorophenyl)methyl]sulfanyl}-1-[2-(4-methoxyphenyl)ethyl]-1H-benzimidazole-5-carboxylate
Chemical Structure Depiction of
ethyl 2-{[(2-bromo-5-fluorophenyl)methyl]sulfanyl}-1-[2-(4-methoxyphenyl)ethyl]-1H-benzimidazole-5-carboxylate
ethyl 2-{[(2-bromo-5-fluorophenyl)methyl]sulfanyl}-1-[2-(4-methoxyphenyl)ethyl]-1H-benzimidazole-5-carboxylate
Compound characteristics
| Compound ID: | V008-5006 |
| Compound Name: | ethyl 2-{[(2-bromo-5-fluorophenyl)methyl]sulfanyl}-1-[2-(4-methoxyphenyl)ethyl]-1H-benzimidazole-5-carboxylate |
| Molecular Weight: | 543.45 |
| Molecular Formula: | C26 H24 Br F N2 O3 S |
| Salt: | not_available |
| Smiles: | CCOC(c1ccc2c(c1)nc(n2CCc1ccc(cc1)OC)SCc1cc(ccc1[Br])F)=O |
| Stereo: | ACHIRAL |
| logP: | 7.5502 |
| logD: | 7.5492 |
| logSw: | -5.6581 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 38.753 |
| InChI Key: | WAHWFKSIKPZHBP-UHFFFAOYSA-N |