1-[2-hydroxy-3-(4-methoxyphenoxy)propyl]-2,3-dimethyl-1H-benzimidazol-3-ium
Chemical Structure Depiction of
1-[2-hydroxy-3-(4-methoxyphenoxy)propyl]-2,3-dimethyl-1H-benzimidazol-3-ium
1-[2-hydroxy-3-(4-methoxyphenoxy)propyl]-2,3-dimethyl-1H-benzimidazol-3-ium
Compound characteristics
| Compound ID: | 5491-0376 |
| Compound Name: | 1-[2-hydroxy-3-(4-methoxyphenoxy)propyl]-2,3-dimethyl-1H-benzimidazol-3-ium |
| Molecular Weight: | 454.31 |
| Molecular Formula: | C19 H23 N2 O3 |
| Salt: | I- |
| Smiles: | Cc1n(CC(COc2ccc(cc2)OC)O)c2ccccc2[n+]1C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1178 |
| logD: | 3.1178 |
| logSw: | -2.9492 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.315 |
| InChI Key: | XJEPJFSOAIPECP-HNNXBMFYSA-N |