5-[(2-butoxyphenyl)methylidene]-2-{4-[(prop-2-en-1-yl)oxy]phenyl}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Chemical Structure Depiction of
5-[(2-butoxyphenyl)methylidene]-2-{4-[(prop-2-en-1-yl)oxy]phenyl}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
5-[(2-butoxyphenyl)methylidene]-2-{4-[(prop-2-en-1-yl)oxy]phenyl}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Compound characteristics
| Compound ID: | 6672-0531 |
| Compound Name: | 5-[(2-butoxyphenyl)methylidene]-2-{4-[(prop-2-en-1-yl)oxy]phenyl}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one |
| Molecular Weight: | 433.53 |
| Molecular Formula: | C24 H23 N3 O3 S |
| Smiles: | CCCCOc1ccccc1\C=C1/C(n2c(nc(c3ccc(cc3)OCC=C)n2)S1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.4174 |
| logD: | 6.4174 |
| logSw: | -5.8109 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.118 |
| InChI Key: | IRXCVIPZKHGICO-UHFFFAOYSA-N |