1-[3-(3-chlorophenoxy)-2-hydroxypropyl]-2,3-dimethyl-1H-benzimidazol-3-ium
Chemical Structure Depiction of
1-[3-(3-chlorophenoxy)-2-hydroxypropyl]-2,3-dimethyl-1H-benzimidazol-3-ium
1-[3-(3-chlorophenoxy)-2-hydroxypropyl]-2,3-dimethyl-1H-benzimidazol-3-ium
Compound characteristics
| Compound ID: | 5491-0396 |
| Compound Name: | 1-[3-(3-chlorophenoxy)-2-hydroxypropyl]-2,3-dimethyl-1H-benzimidazol-3-ium |
| Molecular Weight: | 458.73 |
| Molecular Formula: | C18 H20 Cl N2 O2 |
| Salt: | I- |
| Smiles: | Cc1n(CC(COc2cccc(c2)[Cl])O)c2ccccc2[n+]1C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9314 |
| logD: | 3.9314 |
| logSw: | -3.926 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 28.7714 |
| InChI Key: | CEOWUCQYUSMIJO-HNNXBMFYSA-N |