N-[3-(3,4-dimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-2-[5-methyl-2-(propan-2-yl)phenoxy]acetamide
Chemical Structure Depiction of
N-[3-(3,4-dimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-2-[5-methyl-2-(propan-2-yl)phenoxy]acetamide
N-[3-(3,4-dimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-2-[5-methyl-2-(propan-2-yl)phenoxy]acetamide
Compound characteristics
| Compound ID: | G952-1518 |
| Compound Name: | N-[3-(3,4-dimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-2-[5-methyl-2-(propan-2-yl)phenoxy]acetamide |
| Molecular Weight: | 467.55 |
| Molecular Formula: | C23 H25 N5 O4 S |
| Smiles: | CC(C)c1ccc(C)cc1OCC(Nc1nn2c(c3ccc(c(c3)OC)OC)nnc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6413 |
| logD: | 4.6403 |
| logSw: | -4.4477 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.758 |
| InChI Key: | VHHBNHAEYHFZHQ-UHFFFAOYSA-N |