2-({[3-(4-chlorophenoxy)propyl]sulfanyl}methyl)-1H-benzimidazole
Chemical Structure Depiction of
2-({[3-(4-chlorophenoxy)propyl]sulfanyl}methyl)-1H-benzimidazole
2-({[3-(4-chlorophenoxy)propyl]sulfanyl}methyl)-1H-benzimidazole
Compound characteristics
| Compound ID: | D011-3018 |
| Compound Name: | 2-({[3-(4-chlorophenoxy)propyl]sulfanyl}methyl)-1H-benzimidazole |
| Molecular Weight: | 332.85 |
| Molecular Formula: | C17 H17 Cl N2 O S |
| Smiles: | C(COc1ccc(cc1)[Cl])CSCc1nc2ccccc2[nH]1 |
| Stereo: | ACHIRAL |
| logP: | 4.9898 |
| logD: | 4.9815 |
| logSw: | -5.1382 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 27.6662 |
| InChI Key: | PXXMZUJCFIOCEG-UHFFFAOYSA-N |