2-[(3-cyano-5,6-dimethylpyridin-2-yl)sulfanyl]-N-(5-nitro-1,3-benzothiazol-2-yl)acetamide
Chemical Structure Depiction of
2-[(3-cyano-5,6-dimethylpyridin-2-yl)sulfanyl]-N-(5-nitro-1,3-benzothiazol-2-yl)acetamide
2-[(3-cyano-5,6-dimethylpyridin-2-yl)sulfanyl]-N-(5-nitro-1,3-benzothiazol-2-yl)acetamide
Compound characteristics
| Compound ID: | 8294-0242 |
| Compound Name: | 2-[(3-cyano-5,6-dimethylpyridin-2-yl)sulfanyl]-N-(5-nitro-1,3-benzothiazol-2-yl)acetamide |
| Molecular Weight: | 399.45 |
| Molecular Formula: | C17 H13 N5 O3 S2 |
| Smiles: | Cc1cc(C#N)c(nc1C)SCC(Nc1nc2cc(ccc2s1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1619 |
| logD: | 4.1619 |
| logSw: | -4.305 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 92.639 |
| InChI Key: | DHUDYHMZSVBDAB-UHFFFAOYSA-N |