N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-methyl-3-nitrobenzamide
Chemical Structure Depiction of
N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-methyl-3-nitrobenzamide
N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-methyl-3-nitrobenzamide
Compound characteristics
| Compound ID: | 3617-0496 |
| Compound Name: | N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-methyl-3-nitrobenzamide |
| Molecular Weight: | 292.31 |
| Molecular Formula: | C12 H12 N4 O3 S |
| Smiles: | CCc1nnc(NC(c2cccc(c2C)[N+]([O-])=O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 2.9527 |
| logD: | 0.6223 |
| logSw: | -3.7344 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.45 |
| InChI Key: | QOJSTGLTHOTKHK-UHFFFAOYSA-N |