N-[3-(3-fluorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-3,5-dimethoxybenzamide
Chemical Structure Depiction of
N-[3-(3-fluorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-3,5-dimethoxybenzamide
N-[3-(3-fluorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-3,5-dimethoxybenzamide
Compound characteristics
| Compound ID: | G952-3462 |
| Compound Name: | N-[3-(3-fluorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-3,5-dimethoxybenzamide |
| Molecular Weight: | 399.4 |
| Molecular Formula: | C18 H14 F N5 O3 S |
| Smiles: | COc1cc(cc(c1)OC)C(Nc1nn2c(c3cccc(c3)F)nnc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6891 |
| logD: | 3.6873 |
| logSw: | -4.1413 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.213 |
| InChI Key: | BMJLVHRTLPFBAF-UHFFFAOYSA-N |