ethyl 2-[(5-bromo-2-ethoxyphenyl)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-ethoxyphenyl)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-ethoxyphenyl)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: | 4059-0504 |
| Compound Name: | ethyl 2-[(5-bromo-2-ethoxyphenyl)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: | 585.52 |
| Molecular Formula: | C28 H29 Br N2 O5 S |
| Smiles: | CCOC(C1C(c2ccccc2OC(C)C)N2C(=NC=1C)SC(=C/c1cc(ccc1OCC)[Br])\C2=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.5625 |
| logD: | 6.5625 |
| logSw: | -5.6343 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 59.847 |
| InChI Key: | YHOLSWOROLDFEN-VWLOTQADSA-N |