5-{[2-(hexyloxy)phenyl]methylidene}-2-(pyridin-4-yl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Chemical Structure Depiction of
5-{[2-(hexyloxy)phenyl]methylidene}-2-(pyridin-4-yl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
5-{[2-(hexyloxy)phenyl]methylidene}-2-(pyridin-4-yl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Compound characteristics
| Compound ID: | 5606-4081 |
| Compound Name: | 5-{[2-(hexyloxy)phenyl]methylidene}-2-(pyridin-4-yl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one |
| Molecular Weight: | 406.51 |
| Molecular Formula: | C22 H22 N4 O2 S |
| Smiles: | CCCCCCOc1ccccc1/C=C1/C(n2c(nc(c3ccncc3)n2)S1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6813 |
| logD: | 5.6812 |
| logSw: | -5.2444 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 54.129 |
| InChI Key: | OHZWLMMYPPAAAU-UHFFFAOYSA-N |