2-[2-(4-fluorophenyl)ethenyl]-5-{[4-(pentyloxy)phenyl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Chemical Structure Depiction of
2-[2-(4-fluorophenyl)ethenyl]-5-{[4-(pentyloxy)phenyl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
2-[2-(4-fluorophenyl)ethenyl]-5-{[4-(pentyloxy)phenyl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Compound characteristics
| Compound ID: | Y070-4652 |
| Compound Name: | 2-[2-(4-fluorophenyl)ethenyl]-5-{[4-(pentyloxy)phenyl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one |
| Molecular Weight: | 435.52 |
| Molecular Formula: | C24 H22 F N3 O2 S |
| Smiles: | CCCCCOc1ccc(/C=C2/C(n3c(nc(/C=C/c4ccc(cc4)F)n3)S2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 6.2186 |
| logD: | 6.2186 |
| logSw: | -5.3351 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.604 |
| InChI Key: | CYMYONSKQMZCJR-UHFFFAOYSA-N |