N-[3-(furan-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-3,4,5-trimethoxybenzamide
Chemical Structure Depiction of
N-[3-(furan-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-3,4,5-trimethoxybenzamide
N-[3-(furan-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-3,4,5-trimethoxybenzamide
Compound characteristics
| Compound ID: | E157-3699 |
| Compound Name: | N-[3-(furan-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-3,4,5-trimethoxybenzamide |
| Molecular Weight: | 401.4 |
| Molecular Formula: | C17 H15 N5 O5 S |
| Smiles: | COc1cc(cc(c1OC)OC)C(Nc1nn2c(c3ccco3)nnc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.033 |
| logD: | 2.0316 |
| logSw: | -2.8887 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.682 |
| InChI Key: | JALYAYYWJRODIU-UHFFFAOYSA-N |