7-[3-(dimethylamino)phenyl]-3-(4-methylphenyl)-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one
Chemical Structure Depiction of
7-[3-(dimethylamino)phenyl]-3-(4-methylphenyl)-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one
7-[3-(dimethylamino)phenyl]-3-(4-methylphenyl)-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one
Compound characteristics
| Compound ID: | D727-0554 |
| Compound Name: | 7-[3-(dimethylamino)phenyl]-3-(4-methylphenyl)-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one |
| Molecular Weight: | 363.44 |
| Molecular Formula: | C19 H17 N5 O S |
| Smiles: | Cc1ccc(cc1)C1C(N2C(=NN=1)SC(c1cccc(c1)N(C)C)=N2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.31 |
| logD: | 4.2419 |
| logSw: | -4.4171 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.63 |
| InChI Key: | NUFRGHHOIUJIIP-UHFFFAOYSA-N |