AC1MEU9B
ethyl 7-methyl-2-[[5-(4-methyl-2-nitrophenyl)furan-2-yl]methylidene]-3-oxo-5-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Also Known As: Oprea1_201616|ETHYL (8Z)-4-METHYL-8-[[5-(4-METHYL-2-NITRO-PHENYL)-2-FURYL]METHYLIDENE]-9-OXO-2-PHENYL-7-THIA-1,5-DIAZABICYCLO[4.3.0]NONA-3,5-DIENE-3-CARBOXYLATE|ethyl 7-methyl-2-[[5-(4-methyl-2-nitrophenyl)furan-2-yl]methylidene]-3-oxo-5-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate|Ethyl 7-methyl-2-{[5-(4-methyl-2-nitrophenyl)furan-2-yl]methylidene}-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
| Molecular Formula | C28H23N3O6S |
|---|---|
| Molecular Weight | 529.13074 g/mol |
| LogP | 4.27492 |
| Topological Polar Surface Area | 116.94 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 529.13074 |
| Monoisotopic Mass | 529.13074 |
| Heavy Atoms | 38 |
| Complexity | 1778.727 |
Chemical Identifiers
| CAS Number | 5677-87-2 |
|---|---|
| SMILES | CCOC(=O)C1=C(N=C2N(C1C3=CC=CC=C3)C(=O)C(=CC4=CC=C(O4)C5=C(C=C(C=C5)C)[N+](=O)[O-])S2)C |
Product Overview
AC1MEU9B (CAS 5677-87-2), with molecular formula C28H23N3O6S and molecular weight 529.13074 g/mol. IUPAC: ethyl 7-methyl-2-[[5-(4-methyl-2-nitrophenyl)furan-2-yl]methylidene]-3-oxo-5-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate.