N-[3-(3-chloro-4-fluorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-4-ethoxybenzamide
Chemical Structure Depiction of
N-[3-(3-chloro-4-fluorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-4-ethoxybenzamide
N-[3-(3-chloro-4-fluorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-4-ethoxybenzamide
Compound characteristics
| Compound ID: | G952-3219 |
| Compound Name: | N-[3-(3-chloro-4-fluorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-4-ethoxybenzamide |
| Molecular Weight: | 417.85 |
| Molecular Formula: | C18 H13 Cl F N5 O2 S |
| Smiles: | CCOc1ccc(cc1)C(Nc1nn2c(c3ccc(c(c3)[Cl])F)nnc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2098 |
| logD: | 4.1957 |
| logSw: | -4.5504 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.249 |
| InChI Key: | OHURMPFIMJHVDX-UHFFFAOYSA-N |