3-[1-(3,5-dimethoxyphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-N-(4-ethoxyphenyl)-1,2,4-thiadiazol-5-amine
Chemical Structure Depiction of
3-[1-(3,5-dimethoxyphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-N-(4-ethoxyphenyl)-1,2,4-thiadiazol-5-amine
3-[1-(3,5-dimethoxyphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-N-(4-ethoxyphenyl)-1,2,4-thiadiazol-5-amine
Compound characteristics
| Compound ID: | M213-0431 |
| Compound Name: | 3-[1-(3,5-dimethoxyphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-N-(4-ethoxyphenyl)-1,2,4-thiadiazol-5-amine |
| Molecular Weight: | 438.51 |
| Molecular Formula: | C21 H22 N6 O3 S |
| Smiles: | CCOc1ccc(cc1)Nc1nc(c2c(C)n(c3cc(cc(c3)OC)OC)nn2)ns1 |
| Stereo: | ACHIRAL |
| logP: | 4.9004 |
| logD: | 4.9004 |
| logSw: | -4.6072 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.793 |
| InChI Key: | ORORGVLMPTZFDD-UHFFFAOYSA-N |