7-(3,5-dimethoxyphenyl)-3-(4-methylphenyl)-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one
Chemical Structure Depiction of
7-(3,5-dimethoxyphenyl)-3-(4-methylphenyl)-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one
7-(3,5-dimethoxyphenyl)-3-(4-methylphenyl)-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one
Compound characteristics
| Compound ID: | D727-0552 |
| Compound Name: | 7-(3,5-dimethoxyphenyl)-3-(4-methylphenyl)-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one |
| Molecular Weight: | 380.42 |
| Molecular Formula: | C19 H16 N4 O3 S |
| Smiles: | Cc1ccc(cc1)C1C(N2C(=NN=1)SC(c1cc(cc(c1)OC)OC)=N2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1349 |
| logD: | 4.1118 |
| logSw: | -4.2782 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 62.912 |
| InChI Key: | MAUPIHPANPYEPO-UHFFFAOYSA-N |