N-(5-butyl-1,3,4-thiadiazol-2-yl)-4,5-dimethoxy-2-nitrobenzamide
Chemical Structure Depiction of
N-(5-butyl-1,3,4-thiadiazol-2-yl)-4,5-dimethoxy-2-nitrobenzamide
N-(5-butyl-1,3,4-thiadiazol-2-yl)-4,5-dimethoxy-2-nitrobenzamide
Compound characteristics
| Compound ID: | Y032-3781 |
| Compound Name: | N-(5-butyl-1,3,4-thiadiazol-2-yl)-4,5-dimethoxy-2-nitrobenzamide |
| Molecular Weight: | 366.39 |
| Molecular Formula: | C15 H18 N4 O5 S |
| Smiles: | CCCCc1nnc(NC(c2cc(c(cc2[N+]([O-])=O)OC)OC)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.212 |
| logD: | 1.0193 |
| logSw: | -3.7379 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 95.711 |
| InChI Key: | ZFOGKHOOZHIZCY-UHFFFAOYSA-N |