5-[(3,4-diethoxyphenyl)methylidene]-2-(3-methylphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Chemical Structure Depiction of
5-[(3,4-diethoxyphenyl)methylidene]-2-(3-methylphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
5-[(3,4-diethoxyphenyl)methylidene]-2-(3-methylphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Compound characteristics
| Compound ID: | 6187-1996 |
| Compound Name: | 5-[(3,4-diethoxyphenyl)methylidene]-2-(3-methylphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one |
| Molecular Weight: | 407.49 |
| Molecular Formula: | C22 H21 N3 O3 S |
| Smiles: | [H]C(=C1/C(n2c(nc(c3cccc(C)c3)n2)S1)=O)\c1ccc(c(c1)OCC)OCC |
| Stereo: | ACHIRAL |
| logP: | 4.5504 |
| logD: | 4.5504 |
| logSw: | -4.477 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.616 |
| InChI Key: | WECCLQWYXSIOTH-UHFFFAOYSA-N |