2-{[5-methyl-2-(propan-2-yl)phenoxy]methyl}-1-(prop-2-yn-1-yl)-1H-benzimidazole
Chemical Structure Depiction of
2-{[5-methyl-2-(propan-2-yl)phenoxy]methyl}-1-(prop-2-yn-1-yl)-1H-benzimidazole
2-{[5-methyl-2-(propan-2-yl)phenoxy]methyl}-1-(prop-2-yn-1-yl)-1H-benzimidazole
Compound characteristics
| Compound ID: | D011-5813 |
| Compound Name: | 2-{[5-methyl-2-(propan-2-yl)phenoxy]methyl}-1-(prop-2-yn-1-yl)-1H-benzimidazole |
| Molecular Weight: | 318.42 |
| Molecular Formula: | C21 H22 N2 O |
| Smiles: | CC(C)c1ccc(C)cc1OCc1nc2ccccc2n1CC#C |
| Stereo: | ACHIRAL |
| logP: | 5.6538 |
| logD: | 5.6533 |
| logSw: | -5.4988 |
| Hydrogen bond acceptors count: | 2 |
| Polar surface area: | 18.7074 |
| InChI Key: | ZADVDBQOCUTSRP-UHFFFAOYSA-N |