N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-2-(2-nitrophenyl)acetamide
Chemical Structure Depiction of
N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-2-(2-nitrophenyl)acetamide
N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-2-(2-nitrophenyl)acetamide
Compound characteristics
| Compound ID: | Y205-5947 |
| Compound Name: | N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-2-(2-nitrophenyl)acetamide |
| Molecular Weight: | 324.38 |
| Molecular Formula: | C12 H12 N4 O3 S2 |
| Smiles: | CCSc1nnc(NC(Cc2ccccc2[N+]([O-])=O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.444 |
| logD: | 3.4367 |
| logSw: | -3.7484 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.103 |
| InChI Key: | JOSHLZKXCOKIRO-UHFFFAOYSA-N |