5-[(4-butoxy-3-methoxyphenyl)methylidene]-2-(pyridin-3-yl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Chemical Structure Depiction of
5-[(4-butoxy-3-methoxyphenyl)methylidene]-2-(pyridin-3-yl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
5-[(4-butoxy-3-methoxyphenyl)methylidene]-2-(pyridin-3-yl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Compound characteristics
| Compound ID: | 4341-3251 |
| Compound Name: | 5-[(4-butoxy-3-methoxyphenyl)methylidene]-2-(pyridin-3-yl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one |
| Molecular Weight: | 408.48 |
| Molecular Formula: | C21 H20 N4 O3 S |
| Smiles: | CCCCOc1ccc(/C=C2/C(n3c(nc(c4cccnc4)n3)S2)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 3.7043 |
| logD: | 3.637 |
| logSw: | -3.7177 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.849 |
| InChI Key: | RNZHJCYICFDFLG-UHFFFAOYSA-N |