2-{[3-(3-methylphenoxy)propyl]sulfanyl}-1H-benzimidazole--hydrogen chloride (1/1)
Chemical Structure Depiction of
2-{[3-(3-methylphenoxy)propyl]sulfanyl}-1H-benzimidazole--hydrogen chloride (1/1)
2-{[3-(3-methylphenoxy)propyl]sulfanyl}-1H-benzimidazole--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | Y080-1984 |
| Compound Name: | 2-{[3-(3-methylphenoxy)propyl]sulfanyl}-1H-benzimidazole--hydrogen chloride (1/1) |
| Molecular Weight: | 334.87 |
| Molecular Formula: | C17 H18 N2 O S |
| Salt: | HCl |
| Smiles: | Cc1cccc(c1)OCCCSc1nc2ccccc2[nH]1 |
| Stereo: | ACHIRAL |
| logP: | 4.4945 |
| logD: | 4.4922 |
| logSw: | -4.3213 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 25.3977 |
| InChI Key: | DAHFXZPZJRHHDM-UHFFFAOYSA-N |