4,5-dimethoxy-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-2-nitrobenzamide
Chemical Structure Depiction of
4,5-dimethoxy-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-2-nitrobenzamide
4,5-dimethoxy-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-2-nitrobenzamide
Compound characteristics
| Compound ID: | Y032-2487 |
| Compound Name: | 4,5-dimethoxy-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-2-nitrobenzamide |
| Molecular Weight: | 366.39 |
| Molecular Formula: | C15 H18 N4 O5 S |
| Smiles: | CC(C)Cc1nnc(NC(c2cc(c(cc2[N+]([O-])=O)OC)OC)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.0815 |
| logD: | 0.8889 |
| logSw: | -3.599 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 95.711 |
| InChI Key: | QINGNMZERMDILN-UHFFFAOYSA-N |