3-ethyl-1-[2-hydroxy-3-(2-methoxyphenoxy)propyl]-1H-benzimidazol-3-ium
Chemical Structure Depiction of
3-ethyl-1-[2-hydroxy-3-(2-methoxyphenoxy)propyl]-1H-benzimidazol-3-ium
3-ethyl-1-[2-hydroxy-3-(2-methoxyphenoxy)propyl]-1H-benzimidazol-3-ium
Compound characteristics
| Compound ID: | 5010-0487 |
| Compound Name: | 3-ethyl-1-[2-hydroxy-3-(2-methoxyphenoxy)propyl]-1H-benzimidazol-3-ium |
| Molecular Weight: | 454.31 |
| Molecular Formula: | C19 H23 N2 O3 |
| Salt: | I- |
| Smiles: | CC[n+]1cn(CC(COc2ccccc2OC)O)c2ccccc12 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0339 |
| logD: | 3.0339 |
| logSw: | -3.0389 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 34.965 |
| InChI Key: | WBURJNXHZZBLKC-HNNXBMFYSA-N |