ethyl 2-[(3-hydroxy-4-methoxyphenyl)methylidene]-7-methyl-3-oxo-5-{4-[(propan-2-yl)oxy]phenyl}-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
ethyl 2-[(3-hydroxy-4-methoxyphenyl)methylidene]-7-methyl-3-oxo-5-{4-[(propan-2-yl)oxy]phenyl}-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
ethyl 2-[(3-hydroxy-4-methoxyphenyl)methylidene]-7-methyl-3-oxo-5-{4-[(propan-2-yl)oxy]phenyl}-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | 3977-0780 |
| Compound Name: | ethyl 2-[(3-hydroxy-4-methoxyphenyl)methylidene]-7-methyl-3-oxo-5-{4-[(propan-2-yl)oxy]phenyl}-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 508.59 |
| Molecular Formula: | C27 H28 N2 O6 S |
| Smiles: | CCOC(C1C(c2ccc(cc2)OC(C)C)N2C(=NC=1C)SC(=C/c1ccc(c(c1)O)OC)\C2=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4931 |
| logD: | 4.4872 |
| logSw: | -4.097 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.729 |
| InChI Key: | ABPBRWSSXLUKCB-XMMPIXPASA-N |