N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-2-nitrobenzamide
Chemical Structure Depiction of
N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-2-nitrobenzamide
N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-2-nitrobenzamide
Compound characteristics
| Compound ID: | Y204-3079 |
| Compound Name: | N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-2-nitrobenzamide |
| Molecular Weight: | 310.35 |
| Molecular Formula: | C11 H10 N4 O3 S2 |
| Smiles: | CCSc1nnc(NC(c2ccccc2[N+]([O-])=O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.1522 |
| logD: | 1.3975 |
| logSw: | -3.8253 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.316 |
| InChI Key: | PWLZGGVFIUIUNR-UHFFFAOYSA-N |