5-[(3-chlorophenyl)methylidene]-2-(4-methylphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Chemical Structure Depiction of
5-[(3-chlorophenyl)methylidene]-2-(4-methylphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
5-[(3-chlorophenyl)methylidene]-2-(4-methylphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Compound characteristics
| Compound ID: | 5629-0334 |
| Compound Name: | 5-[(3-chlorophenyl)methylidene]-2-(4-methylphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one |
| Molecular Weight: | 353.83 |
| Molecular Formula: | C18 H12 Cl N3 O S |
| Smiles: | [H]C(=C1/C(n2c(nc(c3ccc(C)cc3)n2)S1)=O)\c1cccc(c1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.0536 |
| logD: | 5.0536 |
| logSw: | -5.2961 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.196 |
| InChI Key: | MCQYIGLGKXFUJO-UHFFFAOYSA-N |