5-{[4-(dimethylamino)phenyl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Chemical Structure Depiction of
5-{[4-(dimethylamino)phenyl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
5-{[4-(dimethylamino)phenyl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Compound characteristics
| Compound ID: | 5629-0482 |
| Compound Name: | 5-{[4-(dimethylamino)phenyl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one |
| Molecular Weight: | 272.33 |
| Molecular Formula: | C13 H12 N4 O S |
| Smiles: | [H]C(=C1/C(n2c(nc([H])n2)S1)=O)\c1ccc(cc1)N(C)C |
| Stereo: | ACHIRAL |
| logP: | 1.9967 |
| logD: | 1.9967 |
| logSw: | -2.455 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.213 |
| InChI Key: | UMLPWDJUCCFABO-UHFFFAOYSA-N |