N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-methoxy-3-nitrobenzamide
Chemical Structure Depiction of
N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-methoxy-3-nitrobenzamide
N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-methoxy-3-nitrobenzamide
Compound characteristics
| Compound ID: | 3617-0689 |
| Compound Name: | N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-methoxy-3-nitrobenzamide |
| Molecular Weight: | 308.31 |
| Molecular Formula: | C12 H12 N4 O4 S |
| Smiles: | CCc1nnc(NC(c2ccc(c(c2)[N+]([O-])=O)OC)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 2.2105 |
| logD: | 0.7106 |
| logSw: | -2.9559 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.081 |
| InChI Key: | XVQJREKQBOXYTM-UHFFFAOYSA-N |