ethyl 5-(3,4-diethoxyphenyl)-2-[(3-hydroxy-4-methoxyphenyl)methylidene]-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
ethyl 5-(3,4-diethoxyphenyl)-2-[(3-hydroxy-4-methoxyphenyl)methylidene]-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
ethyl 5-(3,4-diethoxyphenyl)-2-[(3-hydroxy-4-methoxyphenyl)methylidene]-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
Compound ID: | 4059-0769 |
Compound Name: | ethyl 5-(3,4-diethoxyphenyl)-2-[(3-hydroxy-4-methoxyphenyl)methylidene]-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
Molecular Weight: | 538.62 |
Molecular Formula: | C28 H30 N2 O7 S |
Smiles: | CCOC(C1C(c2ccc(c(c2)OCC)OCC)N2C(=NC=1C)SC(=C/c1ccc(c(c1)O)OC)\C2=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.9804 |
logD: | 3.9745 |
logSw: | -3.6485 |
Hydrogen bond acceptors count: | 11 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 84.346 |
InChI Key: | CINMHSYRUKMUFV-RUZDIDTESA-N |