2-{[(1H-benzimidazol-2-yl)methyl]sulfanyl}-4,6-dimethylpyridine-3-carbonitrile
Chemical Structure Depiction of
2-{[(1H-benzimidazol-2-yl)methyl]sulfanyl}-4,6-dimethylpyridine-3-carbonitrile
2-{[(1H-benzimidazol-2-yl)methyl]sulfanyl}-4,6-dimethylpyridine-3-carbonitrile
Compound characteristics
| Compound ID: | 8012-0562 |
| Compound Name: | 2-{[(1H-benzimidazol-2-yl)methyl]sulfanyl}-4,6-dimethylpyridine-3-carbonitrile |
| Molecular Weight: | 294.38 |
| Molecular Formula: | C16 H14 N4 S |
| Smiles: | Cc1cc(C)nc(c1C#N)SCc1nc2ccccc2[nH]1 |
| Stereo: | ACHIRAL |
| logP: | 3.5885 |
| logD: | 3.5881 |
| logSw: | -3.8704 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.858 |
| InChI Key: | WPJVQVKEGZOOOJ-UHFFFAOYSA-N |