2-{[2-(3-methoxyphenoxy)ethyl]sulfanyl}-1-(prop-2-yn-1-yl)-1H-benzimidazole
Chemical Structure Depiction of
2-{[2-(3-methoxyphenoxy)ethyl]sulfanyl}-1-(prop-2-yn-1-yl)-1H-benzimidazole
2-{[2-(3-methoxyphenoxy)ethyl]sulfanyl}-1-(prop-2-yn-1-yl)-1H-benzimidazole
Compound characteristics
| Compound ID: | D347-0391 |
| Compound Name: | 2-{[2-(3-methoxyphenoxy)ethyl]sulfanyl}-1-(prop-2-yn-1-yl)-1H-benzimidazole |
| Molecular Weight: | 338.43 |
| Molecular Formula: | C19 H18 N2 O2 S |
| Smiles: | COc1cccc(c1)OCCSc1nc2ccccc2n1CC#C |
| Stereo: | ACHIRAL |
| logP: | 4.6304 |
| logD: | 4.6296 |
| logSw: | -4.5344 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 25.6888 |
| InChI Key: | HDIGAPTWSZBNDO-UHFFFAOYSA-N |