4-({2-[4-(hexyloxy)phenyl]-6-oxo[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene}methyl)-2-methoxyphenyl acetate
Chemical Structure Depiction of
4-({2-[4-(hexyloxy)phenyl]-6-oxo[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene}methyl)-2-methoxyphenyl acetate
4-({2-[4-(hexyloxy)phenyl]-6-oxo[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene}methyl)-2-methoxyphenyl acetate
Compound characteristics
| Compound ID: | 6672-0096 |
| Compound Name: | 4-({2-[4-(hexyloxy)phenyl]-6-oxo[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene}methyl)-2-methoxyphenyl acetate |
| Molecular Weight: | 493.58 |
| Molecular Formula: | C26 H27 N3 O5 S |
| Smiles: | CCCCCCOc1ccc(cc1)c1nc2n(C(/C(=C/c3ccc(c(c3)OC)OC(C)=O)S2)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 6.0817 |
| logD: | 6.0817 |
| logSw: | -5.2803 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 73.082 |
| InChI Key: | ASCZAPYTSIWEAV-UHFFFAOYSA-N |