2-(4-ethoxyphenyl)-5-({5-[3-(trifluoromethyl)phenyl]furan-2-yl}methylidene)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Chemical Structure Depiction of
2-(4-ethoxyphenyl)-5-({5-[3-(trifluoromethyl)phenyl]furan-2-yl}methylidene)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
2-(4-ethoxyphenyl)-5-({5-[3-(trifluoromethyl)phenyl]furan-2-yl}methylidene)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Compound characteristics
| Compound ID: | 5629-0090 |
| Compound Name: | 2-(4-ethoxyphenyl)-5-({5-[3-(trifluoromethyl)phenyl]furan-2-yl}methylidene)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one |
| Molecular Weight: | 483.47 |
| Molecular Formula: | C24 H16 F3 N3 O3 S |
| Smiles: | [H]C(=C1/C(n2c(nc(c3ccc(cc3)OCC)n2)S1)=O)\c1ccc(c2cccc(c2)C(F)(F)F)o1 |
| Stereo: | ACHIRAL |
| logP: | 6.4817 |
| logD: | 6.4817 |
| logSw: | -5.8123 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.889 |
| InChI Key: | FVZGQRCSTRLVHS-UHFFFAOYSA-N |