1-{2-[4-methyl-2-(propan-2-yl)phenoxy]ethyl}-1H-benzimidazole-2-thiol
Chemical Structure Depiction of
1-{2-[4-methyl-2-(propan-2-yl)phenoxy]ethyl}-1H-benzimidazole-2-thiol
1-{2-[4-methyl-2-(propan-2-yl)phenoxy]ethyl}-1H-benzimidazole-2-thiol
Compound characteristics
| Compound ID: | 2001-0068 |
| Compound Name: | 1-{2-[4-methyl-2-(propan-2-yl)phenoxy]ethyl}-1H-benzimidazole-2-thiol |
| Molecular Weight: | 326.46 |
| Molecular Formula: | C19 H22 N2 O S |
| Smiles: | CC(C)c1cc(C)ccc1OCCn1c2ccccc2nc1S |
| Stereo: | ACHIRAL |
| logP: | 5.5581 |
| logD: | 5.5578 |
| logSw: | -5.5056 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 16.7053 |
| InChI Key: | ZDYAAMWLXNIXQT-UHFFFAOYSA-N |