N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-2-(4-nitrophenyl)acetamide
Chemical Structure Depiction of
N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-2-(4-nitrophenyl)acetamide
N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-2-(4-nitrophenyl)acetamide
Compound characteristics
| Compound ID: | 0938-7753 |
| Compound Name: | N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-2-(4-nitrophenyl)acetamide |
| Molecular Weight: | 324.38 |
| Molecular Formula: | C12 H12 N4 O3 S2 |
| Smiles: | CCSc1nnc(NC(Cc2ccc(cc2)[N+]([O-])=O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.1784 |
| logD: | 3.1674 |
| logSw: | -3.4659 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.404 |
| InChI Key: | GEXSFYGPUKSRRM-UHFFFAOYSA-N |