ethyl 2-[(2-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-5-(3,4-dimethoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
ethyl 2-[(2-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-5-(3,4-dimethoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
ethyl 2-[(2-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-5-(3,4-dimethoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | 8009-0354 |
| Compound Name: | ethyl 2-[(2-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-5-(3,4-dimethoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 589.46 |
| Molecular Formula: | C26 H25 Br N2 O7 S |
| Smiles: | CCOC(C1C(c2ccc(c(c2)OC)OC)N2C(=NC=1C)SC(=C\c1cc(c(cc1[Br])O)OC)\C2=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1012 |
| logD: | 4.0726 |
| logSw: | -3.9752 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.187 |
| InChI Key: | PXYMBGQZYVOYJO-QHCPKHFHSA-N |