5-[(4-butoxy-3-ethoxyphenyl)methylidene]-2-(2,3-dihydro-1,4-benzodioxin-2-yl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Chemical Structure Depiction of
5-[(4-butoxy-3-ethoxyphenyl)methylidene]-2-(2,3-dihydro-1,4-benzodioxin-2-yl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
5-[(4-butoxy-3-ethoxyphenyl)methylidene]-2-(2,3-dihydro-1,4-benzodioxin-2-yl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Compound characteristics
| Compound ID: | 5606-4394 |
| Compound Name: | 5-[(4-butoxy-3-ethoxyphenyl)methylidene]-2-(2,3-dihydro-1,4-benzodioxin-2-yl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one |
| Molecular Weight: | 479.55 |
| Molecular Formula: | C25 H25 N3 O5 S |
| Smiles: | CCCCOc1ccc(/C=C2/C(n3c(nc(C4COc5ccccc5O4)n3)S2)=O)cc1OCC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.9491 |
| logD: | 4.9491 |
| logSw: | -4.6471 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 67.348 |
| InChI Key: | SVXOZZWCAZQVHI-NRFANRHFSA-N |