1-[3-(4-fluorophenoxy)-2-hydroxypropyl]-3-methyl-2-propyl-1H-benzimidazol-3-ium--iodide (1/1)
Chemical Structure Depiction of
1-[3-(4-fluorophenoxy)-2-hydroxypropyl]-3-methyl-2-propyl-1H-benzimidazol-3-ium--iodide (1/1)
1-[3-(4-fluorophenoxy)-2-hydroxypropyl]-3-methyl-2-propyl-1H-benzimidazol-3-ium--iodide (1/1)
Compound characteristics
| Compound ID: | 5103-0655 |
| Compound Name: | 1-[3-(4-fluorophenoxy)-2-hydroxypropyl]-3-methyl-2-propyl-1H-benzimidazol-3-ium--iodide (1/1) |
| Molecular Weight: | 470.32 |
| Molecular Formula: | C20 H24 F N2 O2 |
| Salt: | I- |
| Smiles: | CCCc1n(CC(COc2ccc(cc2)F)O)c2ccccc2[n+]1C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.342 |
| logD: | 4.342 |
| logSw: | -4.1937 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 27.7921 |
| InChI Key: | KYPGNUFDAKCRCO-INIZCTEOSA-N |