4-{[2-(2-chloro-5-iodophenyl)-5-oxo-1,3-thiazol-4(5H)-ylidene]methyl}-2,6-dimethoxyphenyl acetate
Chemical Structure Depiction of
4-{[2-(2-chloro-5-iodophenyl)-5-oxo-1,3-thiazol-4(5H)-ylidene]methyl}-2,6-dimethoxyphenyl acetate
4-{[2-(2-chloro-5-iodophenyl)-5-oxo-1,3-thiazol-4(5H)-ylidene]methyl}-2,6-dimethoxyphenyl acetate
Compound characteristics
| Compound ID: | 8008-7637 |
| Compound Name: | 4-{[2-(2-chloro-5-iodophenyl)-5-oxo-1,3-thiazol-4(5H)-ylidene]methyl}-2,6-dimethoxyphenyl acetate |
| Molecular Weight: | 543.76 |
| Molecular Formula: | C20 H15 Cl I N O5 S |
| Smiles: | CC(=O)Oc1c(cc(\C=C2/C(=O)SC(c3cc(ccc3[Cl])I)=N2)cc1OC)OC |
| Stereo: | ACHIRAL |
| logP: | 5.5445 |
| logD: | 5.5445 |
| logSw: | -6.0247 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 57.848 |
| InChI Key: | HEOYJEQGKBDJEJ-UHFFFAOYSA-N |