5-({2-[(prop-2-en-1-yl)oxy]phenyl}methylidene)-2-(3,4,5-trimethoxyphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Chemical Structure Depiction of
5-({2-[(prop-2-en-1-yl)oxy]phenyl}methylidene)-2-(3,4,5-trimethoxyphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
5-({2-[(prop-2-en-1-yl)oxy]phenyl}methylidene)-2-(3,4,5-trimethoxyphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Compound characteristics
| Compound ID: | 6187-2054 |
| Compound Name: | 5-({2-[(prop-2-en-1-yl)oxy]phenyl}methylidene)-2-(3,4,5-trimethoxyphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one |
| Molecular Weight: | 451.5 |
| Molecular Formula: | C23 H21 N3 O5 S |
| Smiles: | [H]C(=C1/C(n2c(nc(c3cc(c(c(c3)OC)OC)OC)n2)S1)=O)\c1ccccc1OCC=C |
| Stereo: | ACHIRAL |
| logP: | 4.6557 |
| logD: | 4.6557 |
| logSw: | -4.5395 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 67.678 |
| InChI Key: | HJJLOANPAMDHCW-UHFFFAOYSA-N |