ethyl 2-[(5-bromo-2,4-dimethoxyphenyl)methylidene]-7-methyl-3-oxo-5-(thiophen-2-yl)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
ethyl 2-[(5-bromo-2,4-dimethoxyphenyl)methylidene]-7-methyl-3-oxo-5-(thiophen-2-yl)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
ethyl 2-[(5-bromo-2,4-dimethoxyphenyl)methylidene]-7-methyl-3-oxo-5-(thiophen-2-yl)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
Compound ID: | 3270-0389 |
Compound Name: | ethyl 2-[(5-bromo-2,4-dimethoxyphenyl)methylidene]-7-methyl-3-oxo-5-(thiophen-2-yl)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
Molecular Weight: | 549.46 |
Molecular Formula: | C23 H21 Br N2 O5 S2 |
Smiles: | CCOC(C1C(c2cccs2)N2C(=NC=1C)SC(=C/c1cc(c(cc1OC)OC)[Br])\C2=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 4.8926 |
logD: | 4.8926 |
logSw: | -4.6589 |
Hydrogen bond acceptors count: | 9 |
Polar surface area: | 62.027 |
InChI Key: | HTHJNQGWFRXMGI-FQEVSTJZSA-N |