5-bromo-2-{[2-(4-methoxyphenoxy)ethyl]sulfanyl}-1H-benzimidazole
Chemical Structure Depiction of
5-bromo-2-{[2-(4-methoxyphenoxy)ethyl]sulfanyl}-1H-benzimidazole
5-bromo-2-{[2-(4-methoxyphenoxy)ethyl]sulfanyl}-1H-benzimidazole
Compound characteristics
| Compound ID: | D058-0133 |
| Compound Name: | 5-bromo-2-{[2-(4-methoxyphenoxy)ethyl]sulfanyl}-1H-benzimidazole |
| Molecular Weight: | 379.27 |
| Molecular Formula: | C16 H15 Br N2 O2 S |
| Smiles: | COc1ccc(cc1)OCCSc1nc2cc(ccc2[nH]1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 4.1945 |
| logD: | 4.1933 |
| logSw: | -4.2959 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 32.942 |
| InChI Key: | VJEFVNMYASGZHS-UHFFFAOYSA-N |