N-[3-(4-chlorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-2-methylpropanamide
Chemical Structure Depiction of
N-[3-(4-chlorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-2-methylpropanamide
N-[3-(4-chlorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-2-methylpropanamide
Compound characteristics
| Compound ID: | G952-0470 |
| Compound Name: | N-[3-(4-chlorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-2-methylpropanamide |
| Molecular Weight: | 321.79 |
| Molecular Formula: | C13 H12 Cl N5 O S |
| Smiles: | CC(C)C(Nc1nn2c(c3ccc(cc3)[Cl])nnc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3164 |
| logD: | 3.3148 |
| logSw: | -3.875 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.397 |
| InChI Key: | AXDXWBPCMFDQPU-UHFFFAOYSA-N |