2-[(4-tert-butylphenoxy)methyl]-1-(prop-2-yn-1-yl)-1H-benzimidazole
Chemical Structure Depiction of
2-[(4-tert-butylphenoxy)methyl]-1-(prop-2-yn-1-yl)-1H-benzimidazole
2-[(4-tert-butylphenoxy)methyl]-1-(prop-2-yn-1-yl)-1H-benzimidazole
Compound characteristics
| Compound ID: | D011-5864 |
| Compound Name: | 2-[(4-tert-butylphenoxy)methyl]-1-(prop-2-yn-1-yl)-1H-benzimidazole |
| Molecular Weight: | 318.42 |
| Molecular Formula: | C21 H22 N2 O |
| Smiles: | CC(C)(C)c1ccc(cc1)OCc1nc2ccccc2n1CC#C |
| Stereo: | ACHIRAL |
| logP: | 5.6667 |
| logD: | 5.6666 |
| logSw: | -5.6955 |
| Hydrogen bond acceptors count: | 2 |
| Polar surface area: | 18.6207 |
| InChI Key: | PHGBYAUKWCAKDC-UHFFFAOYSA-N |