ethyl 2-[(3-bromo-4-methoxyphenyl)methylidene]-7-methyl-5-[4-(methylsulfanyl)phenyl]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
ethyl 2-[(3-bromo-4-methoxyphenyl)methylidene]-7-methyl-5-[4-(methylsulfanyl)phenyl]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
ethyl 2-[(3-bromo-4-methoxyphenyl)methylidene]-7-methyl-5-[4-(methylsulfanyl)phenyl]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | 4489-4786 |
| Compound Name: | ethyl 2-[(3-bromo-4-methoxyphenyl)methylidene]-7-methyl-5-[4-(methylsulfanyl)phenyl]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 559.5 |
| Molecular Formula: | C25 H23 Br N2 O4 S2 |
| Smiles: | CCOC(C1C(c2ccc(cc2)SC)N2C(=NC=1C)SC(=C/c1ccc(c(c1)[Br])OC)\C2=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.5565 |
| logD: | 5.5565 |
| logSw: | -5.494 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 53.378 |
| InChI Key: | VQMHDAXSJRDXID-QFIPXVFZSA-N |