N-[3-(3,4-dimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-2-(3,5-dimethylphenoxy)acetamide
Chemical Structure Depiction of
N-[3-(3,4-dimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-2-(3,5-dimethylphenoxy)acetamide
N-[3-(3,4-dimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-2-(3,5-dimethylphenoxy)acetamide
Compound characteristics
| Compound ID: | G952-1308 |
| Compound Name: | N-[3-(3,4-dimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-2-(3,5-dimethylphenoxy)acetamide |
| Molecular Weight: | 439.49 |
| Molecular Formula: | C21 H21 N5 O4 S |
| Smiles: | Cc1cc(C)cc(c1)OCC(Nc1nn2c(c3ccc(c(c3)OC)OC)nnc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7428 |
| logD: | 3.7418 |
| logSw: | -4.0478 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.672 |
| InChI Key: | KCJMESGXQXZGAQ-UHFFFAOYSA-N |