5-[(5-bromo-2-methoxyphenyl)methylidene]-2-(pyridin-3-yl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Chemical Structure Depiction of
5-[(5-bromo-2-methoxyphenyl)methylidene]-2-(pyridin-3-yl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
5-[(5-bromo-2-methoxyphenyl)methylidene]-2-(pyridin-3-yl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Compound characteristics
| Compound ID: | 5629-0723 |
| Compound Name: | 5-[(5-bromo-2-methoxyphenyl)methylidene]-2-(pyridin-3-yl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one |
| Molecular Weight: | 415.27 |
| Molecular Formula: | C17 H11 Br N4 O2 S |
| Smiles: | [H]C(=C1/C(n2c(nc(c3cccnc3)n2)S1)=O)\c1cc(ccc1OC)[Br] |
| Stereo: | ACHIRAL |
| logP: | 3.5827 |
| logD: | 3.5154 |
| logSw: | -3.5622 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 54.344 |
| InChI Key: | XTNFTTSUOJBYGA-UHFFFAOYSA-N |