3,4-dimethoxy-N-[3-(thiophen-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]benzamide
Chemical Structure Depiction of
3,4-dimethoxy-N-[3-(thiophen-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]benzamide
3,4-dimethoxy-N-[3-(thiophen-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]benzamide
Compound characteristics
| Compound ID: | E157-3650 |
| Compound Name: | 3,4-dimethoxy-N-[3-(thiophen-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]benzamide |
| Molecular Weight: | 387.44 |
| Molecular Formula: | C16 H13 N5 O3 S2 |
| Smiles: | COc1ccc(cc1OC)C(Nc1nn2c(c3cccs3)nnc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6473 |
| logD: | 2.642 |
| logSw: | -3.2813 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.405 |
| InChI Key: | JQNLQWJSBSIMRE-UHFFFAOYSA-N |