5-[(2-chloro-6-fluorophenyl)methylidene]-2-[4-(hexyloxy)phenyl][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Chemical Structure Depiction of
5-[(2-chloro-6-fluorophenyl)methylidene]-2-[4-(hexyloxy)phenyl][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
5-[(2-chloro-6-fluorophenyl)methylidene]-2-[4-(hexyloxy)phenyl][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Compound characteristics
| Compound ID: | 6672-0092 |
| Compound Name: | 5-[(2-chloro-6-fluorophenyl)methylidene]-2-[4-(hexyloxy)phenyl][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one |
| Molecular Weight: | 457.95 |
| Molecular Formula: | C23 H21 Cl F N3 O2 S |
| Smiles: | CCCCCCOc1ccc(cc1)c1nc2n(C(/C(=C/c3c(cccc3[Cl])F)S2)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 7.0039 |
| logD: | 7.0039 |
| logSw: | -6.3892 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 44.614 |
| InChI Key: | IEVDDYJOXUXTCS-UHFFFAOYSA-N |