1-[3-(4-acetylphenoxy)-2-hydroxypropyl]-2,3-dimethyl-1H-benzimidazol-3-ium--iodide (1/1)
Chemical Structure Depiction of
1-[3-(4-acetylphenoxy)-2-hydroxypropyl]-2,3-dimethyl-1H-benzimidazol-3-ium--iodide (1/1)
1-[3-(4-acetylphenoxy)-2-hydroxypropyl]-2,3-dimethyl-1H-benzimidazol-3-ium--iodide (1/1)
Compound characteristics
| Compound ID: | 5103-0676 |
| Compound Name: | 1-[3-(4-acetylphenoxy)-2-hydroxypropyl]-2,3-dimethyl-1H-benzimidazol-3-ium--iodide (1/1) |
| Molecular Weight: | 466.32 |
| Molecular Formula: | C20 H23 N2 O3 |
| Salt: | I- |
| Smiles: | CC(c1ccc(cc1)OCC(Cn1c2ccccc2[n+](C)c1C)O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6775 |
| logD: | 2.6775 |
| logSw: | -2.7497 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.598 |
| InChI Key: | KIOLHAVQWOWFGO-KRWDZBQOSA-N |