ethyl 2-[(5-bromo-2-hydroxy-3-nitrophenyl)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-[(5-bromo-2-hydroxy-3-nitrophenyl)methylidene]-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
ethyl 2-[(5-bromo-2-hydroxy-3-nitrophenyl)methylidene]-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | 4490-1868 |
| Compound Name: | ethyl 2-[(5-bromo-2-hydroxy-3-nitrophenyl)methylidene]-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 544.38 |
| Molecular Formula: | C23 H18 Br N3 O6 S |
| Smiles: | CCOC(C1C(c2ccccc2)N2C(=NC=1C)SC(=C\c1cc(cc(c1O)[N+]([O-])=O)[Br])\C2=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.4224 |
| logD: | 3.4353 |
| logSw: | -5.2524 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 94.307 |
| InChI Key: | PPPUNKUSHURUJC-IBGZPJMESA-N |