N-[3-(4-chlorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-2-ethylbutanamide
Chemical Structure Depiction of
N-[3-(4-chlorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-2-ethylbutanamide
N-[3-(4-chlorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-2-ethylbutanamide
Compound characteristics
| Compound ID: | G952-0680 |
| Compound Name: | N-[3-(4-chlorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-2-ethylbutanamide |
| Molecular Weight: | 349.84 |
| Molecular Formula: | C15 H16 Cl N5 O S |
| Smiles: | CCC(CC)C(Nc1nn2c(c3ccc(cc3)[Cl])nnc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9646 |
| logD: | 3.9607 |
| logSw: | -4.3987 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.397 |
| InChI Key: | PKYCLPSRNZJIBR-UHFFFAOYSA-N |