N-(2-cyanophenyl)-2-(3-nitro-1H-1,2,4-triazol-1-yl)acetamide
Chemical Structure Depiction of
N-(2-cyanophenyl)-2-(3-nitro-1H-1,2,4-triazol-1-yl)acetamide
N-(2-cyanophenyl)-2-(3-nitro-1H-1,2,4-triazol-1-yl)acetamide
Compound characteristics
| Compound ID: | 8017-2422 |
| Compound Name: | N-(2-cyanophenyl)-2-(3-nitro-1H-1,2,4-triazol-1-yl)acetamide |
| Molecular Weight: | 272.22 |
| Molecular Formula: | C11 H8 N6 O3 |
| Smiles: | C(C(Nc1ccccc1C#N)=O)n1cnc(n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 0.7405 |
| logD: | 0.7394 |
| logSw: | -2.5476 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 96.142 |
| InChI Key: | ONPQENYPURVRPJ-UHFFFAOYSA-N |