N-[3-(3,4-dimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-2-ethylbutanamide
Chemical Structure Depiction of
N-[3-(3,4-dimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-2-ethylbutanamide
N-[3-(3,4-dimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-2-ethylbutanamide
Compound characteristics
| Compound ID: | G952-0678 |
| Compound Name: | N-[3-(3,4-dimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-2-ethylbutanamide |
| Molecular Weight: | 375.45 |
| Molecular Formula: | C17 H21 N5 O3 S |
| Smiles: | CCC(CC)C(Nc1nn2c(c3ccc(c(c3)OC)OC)nnc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9923 |
| logD: | 2.9884 |
| logSw: | -3.3794 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.658 |
| InChI Key: | SQPRXHWJKVWBNB-UHFFFAOYSA-N |