3,3'-[ethane-1,2-diylbis(oxyethane-2,1-diyl)]bis(5-chloro-1-ethyl-2-methyl-1H-benzimidazol-3-ium)--4-methylbenzene-1-sulfonate (1/2)
Chemical Structure Depiction of
3,3'-[ethane-1,2-diylbis(oxyethane-2,1-diyl)]bis(5-chloro-1-ethyl-2-methyl-1H-benzimidazol-3-ium)--4-methylbenzene-1-sulfonate (1/2)
3,3'-[ethane-1,2-diylbis(oxyethane-2,1-diyl)]bis(5-chloro-1-ethyl-2-methyl-1H-benzimidazol-3-ium)--4-methylbenzene-1-sulfonate (1/2)
Compound characteristics
| Compound ID: | 0433-0008 |
| Compound Name: | 3,3'-[ethane-1,2-diylbis(oxyethane-2,1-diyl)]bis(5-chloro-1-ethyl-2-methyl-1H-benzimidazol-3-ium)--4-methylbenzene-1-sulfonate (1/2) |
| Molecular Weight: | 847.88 |
| Molecular Formula: | C26 H34 Cl2 N4 O2 |
| Salt: | 2 p-CH3C6H4SO3- |
| Smiles: | CCn1c2ccc(cc2[n+](CCOCCOCC[n+]2c3cc(ccc3n(CC)c2C)[Cl])c1C)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.6149 |
| logD: | 5.6149 |
| logSw: | -5.874 |
| Hydrogen bond acceptors count: | 2 |
| Polar surface area: | 23.668 |
| InChI Key: | JZOIHQYPOSRARI-UHFFFAOYSA-N |