3-ethyl-1-[3-(4-fluorophenoxy)-2-hydroxypropyl]-2-methyl-1H-benzimidazol-3-ium--iodide (1/1)
Chemical Structure Depiction of
3-ethyl-1-[3-(4-fluorophenoxy)-2-hydroxypropyl]-2-methyl-1H-benzimidazol-3-ium--iodide (1/1)
3-ethyl-1-[3-(4-fluorophenoxy)-2-hydroxypropyl]-2-methyl-1H-benzimidazol-3-ium--iodide (1/1)
Compound characteristics
| Compound ID: | 5103-0523 |
| Compound Name: | 3-ethyl-1-[3-(4-fluorophenoxy)-2-hydroxypropyl]-2-methyl-1H-benzimidazol-3-ium--iodide (1/1) |
| Molecular Weight: | 456.3 |
| Molecular Formula: | C19 H22 F N2 O2 |
| Salt: | I- |
| Smiles: | CC[n+]1c2ccccc2n(CC(COc2ccc(cc2)F)O)c1C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8041 |
| logD: | 3.8041 |
| logSw: | -3.7695 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 27.6861 |
| InChI Key: | FUAGPQZBYNQYKA-INIZCTEOSA-N |