N-[3-(4-chlorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-4-fluorobenzamide
Chemical Structure Depiction of
N-[3-(4-chlorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-4-fluorobenzamide
N-[3-(4-chlorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-4-fluorobenzamide
Compound characteristics
| Compound ID: | G952-0085 |
| Compound Name: | N-[3-(4-chlorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-4-fluorobenzamide |
| Molecular Weight: | 373.79 |
| Molecular Formula: | C16 H9 Cl F N5 O S |
| Smiles: | c1cc(ccc1C(Nc1nn2c(c3ccc(cc3)[Cl])nnc2s1)=O)F |
| Stereo: | ACHIRAL |
| logP: | 3.9265 |
| logD: | 3.7288 |
| logSw: | -4.6006 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.125 |
| InChI Key: | BDBXPYOVVZUXDK-UHFFFAOYSA-N |