2-({[(2,3,5,6-tetramethylphenyl)methyl]sulfanyl}methyl)-1H-benzimidazole
Chemical Structure Depiction of
2-({[(2,3,5,6-tetramethylphenyl)methyl]sulfanyl}methyl)-1H-benzimidazole
2-({[(2,3,5,6-tetramethylphenyl)methyl]sulfanyl}methyl)-1H-benzimidazole
Compound characteristics
| Compound ID: | D011-2964 |
| Compound Name: | 2-({[(2,3,5,6-tetramethylphenyl)methyl]sulfanyl}methyl)-1H-benzimidazole |
| Molecular Weight: | 310.46 |
| Molecular Formula: | C19 H22 N2 S |
| Smiles: | Cc1cc(C)c(C)c(CSCc2nc3ccccc3[nH]2)c1C |
| Stereo: | ACHIRAL |
| logP: | 6.2491 |
| logD: | 6.2482 |
| logSw: | -5.7567 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 20.2484 |
| InChI Key: | KJGYEFISTIPXLR-UHFFFAOYSA-N |