1-[2-hydroxy-3-(3-methoxyphenoxy)propyl]-3,5,6-trimethyl-1H-benzimidazol-3-ium--iodide (1/1)
Chemical Structure Depiction of
1-[2-hydroxy-3-(3-methoxyphenoxy)propyl]-3,5,6-trimethyl-1H-benzimidazol-3-ium--iodide (1/1)
1-[2-hydroxy-3-(3-methoxyphenoxy)propyl]-3,5,6-trimethyl-1H-benzimidazol-3-ium--iodide (1/1)
Compound characteristics
| Compound ID: | 5010-0559 |
| Compound Name: | 1-[2-hydroxy-3-(3-methoxyphenoxy)propyl]-3,5,6-trimethyl-1H-benzimidazol-3-ium--iodide (1/1) |
| Molecular Weight: | 468.33 |
| Molecular Formula: | C20 H25 N2 O3 |
| Salt: | I- |
| Smiles: | Cc1cc2c(cc1C)[n+](C)cn2CC(COc1cccc(c1)OC)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9608 |
| logD: | 3.9608 |
| logSw: | -4.1099 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 35.623 |
| InChI Key: | JCWKZYLXQAHFSG-INIZCTEOSA-N |