3,5-bis{[(1H-benzimidazol-2-yl)methyl]sulfanyl}-1,2-thiazole-4-carbonitrile
Chemical Structure Depiction of
3,5-bis{[(1H-benzimidazol-2-yl)methyl]sulfanyl}-1,2-thiazole-4-carbonitrile
3,5-bis{[(1H-benzimidazol-2-yl)methyl]sulfanyl}-1,2-thiazole-4-carbonitrile
Compound characteristics
| Compound ID: | 8013-2795 |
| Compound Name: | 3,5-bis{[(1H-benzimidazol-2-yl)methyl]sulfanyl}-1,2-thiazole-4-carbonitrile |
| Molecular Weight: | 434.56 |
| Molecular Formula: | C20 H14 N6 S3 |
| Smiles: | C(c1nc2ccccc2[nH]1)Sc1c(C#N)c(SCc2nc3ccccc3[nH]2)sn1 |
| Stereo: | ACHIRAL |
| logP: | 5.2406 |
| logD: | 5.2388 |
| logSw: | -5.5744 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.938 |
| InChI Key: | BNPWPVQZPHKKGJ-UHFFFAOYSA-N |