3-({2-[4-(hexyloxy)phenyl]-6-oxo[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene}methyl)phenyl acetate
Chemical Structure Depiction of
3-({2-[4-(hexyloxy)phenyl]-6-oxo[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene}methyl)phenyl acetate
3-({2-[4-(hexyloxy)phenyl]-6-oxo[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene}methyl)phenyl acetate
Compound characteristics
| Compound ID: | 6672-0083 |
| Compound Name: | 3-({2-[4-(hexyloxy)phenyl]-6-oxo[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene}methyl)phenyl acetate |
| Molecular Weight: | 463.55 |
| Molecular Formula: | C25 H25 N3 O4 S |
| Smiles: | CCCCCCOc1ccc(cc1)c1nc2n(C(/C(=C/c3cccc(c3)OC(C)=O)S2)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.9376 |
| logD: | 5.9376 |
| logSw: | -5.2897 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 65.365 |
| InChI Key: | GWJQCEDKVSEQOX-UHFFFAOYSA-N |