2-({[(2-chloro-6-fluorophenyl)methyl]sulfanyl}methyl)-1H-benzimidazole
Chemical Structure Depiction of
2-({[(2-chloro-6-fluorophenyl)methyl]sulfanyl}methyl)-1H-benzimidazole
2-({[(2-chloro-6-fluorophenyl)methyl]sulfanyl}methyl)-1H-benzimidazole
Compound characteristics
| Compound ID: | D011-2818 |
| Compound Name: | 2-({[(2-chloro-6-fluorophenyl)methyl]sulfanyl}methyl)-1H-benzimidazole |
| Molecular Weight: | 306.79 |
| Molecular Formula: | C15 H12 Cl F N2 S |
| Smiles: | C(c1c(cccc1[Cl])F)SCc1nc2ccccc2[nH]1 |
| Stereo: | ACHIRAL |
| logP: | 4.8781 |
| logD: | 4.8773 |
| logSw: | -5.106 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 20.2484 |
| InChI Key: | XETOTOCTRBUZLG-UHFFFAOYSA-N |