5-[(4-butoxyphenyl)methylidene]-2-[2-(4-chlorophenyl)ethenyl][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Chemical Structure Depiction of
5-[(4-butoxyphenyl)methylidene]-2-[2-(4-chlorophenyl)ethenyl][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
5-[(4-butoxyphenyl)methylidene]-2-[2-(4-chlorophenyl)ethenyl][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Compound characteristics
| Compound ID: | 6672-0187 |
| Compound Name: | 5-[(4-butoxyphenyl)methylidene]-2-[2-(4-chlorophenyl)ethenyl][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one |
| Molecular Weight: | 437.95 |
| Molecular Formula: | C23 H20 Cl N3 O2 S |
| Smiles: | CCCCOc1ccc(\C=C2/C(n3c(nc(/C=C/c4ccc(cc4)[Cl])n3)S2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 6.2341 |
| logD: | 6.2341 |
| logSw: | -6.3318 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.604 |
| InChI Key: | LDWNTIBSOSDPIS-UHFFFAOYSA-N |