ethyl 2-[(2-bromo-5-ethoxy-4-methoxyphenyl)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-[(2-bromo-5-ethoxy-4-methoxyphenyl)methylidene]-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
ethyl 2-[(2-bromo-5-ethoxy-4-methoxyphenyl)methylidene]-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
Compound ID: | 3871-0547 |
Compound Name: | ethyl 2-[(2-bromo-5-ethoxy-4-methoxyphenyl)methylidene]-7-methyl-3-oxo-5-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(c2ccccc2)N2C(=NC=1C)SC(=C/c1cc(c(cc1[Br])OC)OCC)\C2=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 4.7583 |
logD: | 4.7583 |
logSw: | -4.5535 |
Hydrogen bond acceptors count: | 9 |
Polar surface area: | 60.588 |
InChI Key: | LXDAVPATWCRQBG-QHCPKHFHSA-N |