2-{[(4-phenoxybutyl)sulfanyl]methyl}-1H-benzimidazole
Chemical Structure Depiction of
2-{[(4-phenoxybutyl)sulfanyl]methyl}-1H-benzimidazole
2-{[(4-phenoxybutyl)sulfanyl]methyl}-1H-benzimidazole
Compound characteristics
| Compound ID: | D011-3019 |
| Compound Name: | 2-{[(4-phenoxybutyl)sulfanyl]methyl}-1H-benzimidazole |
| Molecular Weight: | 312.43 |
| Molecular Formula: | C18 H20 N2 O S |
| Smiles: | C(CCSCc1nc2ccccc2[nH]1)COc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.8359 |
| logD: | 4.8277 |
| logSw: | -4.8652 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 27.6662 |
| InChI Key: | DDENZSGKFHOUCQ-UHFFFAOYSA-N |