2-(4-butoxyphenyl)-5-[(3,4,5-trimethoxyphenyl)methylidene][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Chemical Structure Depiction of
2-(4-butoxyphenyl)-5-[(3,4,5-trimethoxyphenyl)methylidene][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
2-(4-butoxyphenyl)-5-[(3,4,5-trimethoxyphenyl)methylidene][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Compound characteristics
| Compound ID: | 5629-0686 |
| Compound Name: | 2-(4-butoxyphenyl)-5-[(3,4,5-trimethoxyphenyl)methylidene][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one |
| Molecular Weight: | 467.54 |
| Molecular Formula: | C24 H25 N3 O5 S |
| Smiles: | [H]C(=C1/C(n2c(nc(c3ccc(cc3)OCCCC)n2)S1)=O)\c1cc(c(c(c1)OC)OC)OC |
| Stereo: | ACHIRAL |
| logP: | 5.2726 |
| logD: | 5.2726 |
| logSw: | -5.1102 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 67.592 |
| InChI Key: | OXEVKZQDFBCKMA-UHFFFAOYSA-N |