AC1NT7U4
ethyl (2Z)-5-(5-bromo-2,4-dimethoxyphenyl)-2-[(3-hydroxyphenyl)methylidene]-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Also Known As: HMS599F16|BIM-0014622.P001|ethyl (2Z)-5-(5-bromo-2,4-dimethoxyphenyl)-2-[(3-hydroxyphenyl)methylidene]-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate|SR-01000440672-1|ETHYL (2Z)-5-(5-BROMO-2,4-DIMETHOXYPHENYL)-2-[(3-HYDROXYPHENYL)METHYLIDENE]-7-METHYL-3-OXO-2H,3H,5H-[1,3]THIAZOLO[3,2-A]PYRIMIDINE-6-CARBOXYLATE|ethyl 5-(5-bromo-2,4-dimethoxyphenyl)-2-(3-hydroxybenzylidene)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate|Ethyl (2Z)-5-(5-bromo-2,4-dimethoxyphenyl)-2-[(3-hydroxyphenyl)methylidene]-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
| Molecular Formula | C25H23BrN2O6S |
|---|---|
| Molecular Weight | 558.046 g/mol |
| LogP | 3.2836 |
| Topological Polar Surface Area | 99.35 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 558.046 |
| Monoisotopic Mass | 558.046 |
| Heavy Atoms | 35 |
| Complexity | 1521.6248 |
Chemical Identifiers
| CAS Number | 6089-14-1 |
|---|---|
| SMILES | CCOC(=O)C1=C(N=C2N(C1C3=CC(=C(C=C3OC)OC)Br)C(=O)/C(=C/C4=CC(=CC=C4)O)/S2)C |
Product Overview
AC1NT7U4 (CAS 6089-14-1), with molecular formula C25H23BrN2O6S and molecular weight 558.046 g/mol. IUPAC: ethyl (2Z)-5-(5-bromo-2,4-dimethoxyphenyl)-2-[(3-hydroxyphenyl)methylidene]-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate.
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