ethyl 2-[(4-hydroxy-3,5-diiodophenyl)methylidene]-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
ethyl 2-[(4-hydroxy-3,5-diiodophenyl)methylidene]-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
ethyl 2-[(4-hydroxy-3,5-diiodophenyl)methylidene]-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | 2028-0032 |
| Compound Name: | ethyl 2-[(4-hydroxy-3,5-diiodophenyl)methylidene]-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 672.28 |
| Molecular Formula: | C23 H18 I2 N2 O4 S |
| Smiles: | CCOC(C1C(c2ccccc2)N2C(=NC=1C)SC(=C/c1cc(c(c(c1)I)O)I)\C2=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.1405 |
| logD: | 5.7025 |
| logSw: | -5.3186 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.227 |
| InChI Key: | YXKFEKMKUXSGCQ-IBGZPJMESA-N |