ethyl 2-[(5-bromo-2-hydroxyphenyl)methylidene]-7-methyl-3-oxo-5-{2-[(propan-2-yl)oxy]phenyl}-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
ethyl 2-[(5-bromo-2-hydroxyphenyl)methylidene]-7-methyl-3-oxo-5-{2-[(propan-2-yl)oxy]phenyl}-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
ethyl 2-[(5-bromo-2-hydroxyphenyl)methylidene]-7-methyl-3-oxo-5-{2-[(propan-2-yl)oxy]phenyl}-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
Compound ID: | 4059-0343 |
Compound Name: | ethyl 2-[(5-bromo-2-hydroxyphenyl)methylidene]-7-methyl-3-oxo-5-{2-[(propan-2-yl)oxy]phenyl}-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
Molecular Weight: | 557.46 |
Molecular Formula: | C26 H25 Br N2 O5 S |
Smiles: | CCOC(C1C(c2ccccc2OC(C)C)N2C(=NC=1C)SC(=C/c1cc(ccc1O)[Br])\C2=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 5.7783 |
logD: | 5.7368 |
logSw: | -5.2438 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 69.185 |
InChI Key: | QQDHLXWJRVETIM-QHCPKHFHSA-N |