5-{[5-(4-fluorophenyl)furan-2-yl]methylidene}-2-[4-(hexyloxy)phenyl][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Chemical Structure Depiction of
5-{[5-(4-fluorophenyl)furan-2-yl]methylidene}-2-[4-(hexyloxy)phenyl][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
5-{[5-(4-fluorophenyl)furan-2-yl]methylidene}-2-[4-(hexyloxy)phenyl][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Compound characteristics
| Compound ID: | 6672-0766 |
| Compound Name: | 5-{[5-(4-fluorophenyl)furan-2-yl]methylidene}-2-[4-(hexyloxy)phenyl][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one |
| Molecular Weight: | 489.57 |
| Molecular Formula: | C27 H24 F N3 O3 S |
| Smiles: | CCCCCCOc1ccc(cc1)c1nc2n(C(/C(=C\c3ccc(c4ccc(cc4)F)o3)S2)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 7.912 |
| logD: | 7.912 |
| logSw: | -5.7158 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.183 |
| InChI Key: | IOHXPYFZDQGWMW-UHFFFAOYSA-N |