N-[3-(3,4-dimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-3,5-dimethoxybenzamide
Chemical Structure Depiction of
N-[3-(3,4-dimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-3,5-dimethoxybenzamide
N-[3-(3,4-dimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-3,5-dimethoxybenzamide
Compound characteristics
| Compound ID: | G952-3443 |
| Compound Name: | N-[3-(3,4-dimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-3,5-dimethoxybenzamide |
| Molecular Weight: | 441.46 |
| Molecular Formula: | C20 H19 N5 O5 S |
| Smiles: | COc1cc(cc(c1)OC)C(Nc1nn2c(c3ccc(c(c3)OC)OC)nnc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1906 |
| logD: | 3.1888 |
| logSw: | -3.5708 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.474 |
| InChI Key: | XCNDFMUZAUWPAJ-UHFFFAOYSA-N |