3,4-dimethoxy-N-[3-(phenoxymethyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]benzamide
Chemical Structure Depiction of
3,4-dimethoxy-N-[3-(phenoxymethyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]benzamide
3,4-dimethoxy-N-[3-(phenoxymethyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]benzamide
Compound characteristics
| Compound ID: | E157-3651 |
| Compound Name: | 3,4-dimethoxy-N-[3-(phenoxymethyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]benzamide |
| Molecular Weight: | 411.44 |
| Molecular Formula: | C19 H17 N5 O4 S |
| Smiles: | COc1ccc(cc1OC)C(Nc1nn2c(COc3ccccc3)nnc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3166 |
| logD: | 2.2568 |
| logSw: | -3.0467 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.861 |
| InChI Key: | FRWUHYLNQLELBV-UHFFFAOYSA-N |