5-[(4-butoxy-3-methoxyphenyl)methylidene]-2-(4-chlorophenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Chemical Structure Depiction of
5-[(4-butoxy-3-methoxyphenyl)methylidene]-2-(4-chlorophenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
5-[(4-butoxy-3-methoxyphenyl)methylidene]-2-(4-chlorophenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Compound characteristics
| Compound ID: | 4341-3192 |
| Compound Name: | 5-[(4-butoxy-3-methoxyphenyl)methylidene]-2-(4-chlorophenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one |
| Molecular Weight: | 441.93 |
| Molecular Formula: | C22 H20 Cl N3 O3 S |
| Smiles: | CCCCOc1ccc(/C=C2/C(n3c(nc(c4ccc(cc4)[Cl])n3)S2)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 5.7796 |
| logD: | 5.7796 |
| logSw: | -6.1202 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.331 |
| InChI Key: | AKMPRYXQMPHMQM-UHFFFAOYSA-N |