5-[(3,4-dimethoxyphenyl)methylidene]-2-(4-propoxyphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Chemical Structure Depiction of
5-[(3,4-dimethoxyphenyl)methylidene]-2-(4-propoxyphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
5-[(3,4-dimethoxyphenyl)methylidene]-2-(4-propoxyphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Compound characteristics
| Compound ID: | 4341-1250 |
| Compound Name: | 5-[(3,4-dimethoxyphenyl)methylidene]-2-(4-propoxyphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one |
| Molecular Weight: | 423.49 |
| Molecular Formula: | C22 H21 N3 O4 S |
| Smiles: | CCCOc1ccc(cc1)c1nc2n(C(/C(=C/c3ccc(c(c3)OC)OC)S2)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.6492 |
| logD: | 4.6492 |
| logSw: | -4.5253 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.875 |
| InChI Key: | MSODASBMVYCQTE-UHFFFAOYSA-N |