N-[(3,4-dimethoxyphenyl)methyl]-2-methyl-5-(3-methyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)aniline
Chemical Structure Depiction of
N-[(3,4-dimethoxyphenyl)methyl]-2-methyl-5-(3-methyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)aniline
N-[(3,4-dimethoxyphenyl)methyl]-2-methyl-5-(3-methyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)aniline
Compound characteristics
| Compound ID: | 8017-0591 |
| Compound Name: | N-[(3,4-dimethoxyphenyl)methyl]-2-methyl-5-(3-methyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)aniline |
| Molecular Weight: | 395.48 |
| Molecular Formula: | C20 H21 N5 O2 S |
| Smiles: | [H]N(Cc1ccc(c(c1)OC)OC)c1cc(ccc1C)c1nn2c(C)nnc2s1 |
| Stereo: | ACHIRAL |
| logP: | 2.8294 |
| logD: | 2.8293 |
| logSw: | -3.1741 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.568 |
| InChI Key: | XSXHAKMYUZPPAY-UHFFFAOYSA-N |