AC1MOP99
methyl 5-(4-chlorophenyl)-7-methyl-2-[[5-(2-nitrophenyl)furan-2-yl]methylidene]-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Also Known As: Oprea1_587531|Methyl (E)-5-(4-chlorophenyl)-7-methyl-2-((5-(2-nitrophenyl)furan-2-yl)methylene)-3-oxo-2,3-dihydro-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate|methyl 5-(4-chlorophenyl)-7-methyl-2-[[5-(2-nitrophenyl)furan-2-yl]methylidene]-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
| Molecular Formula | C26H18ClN3O6S |
|---|---|
| Molecular Weight | 535.0605 g/mol |
| LogP | 4.2298 |
| Topological Polar Surface Area | 116.94 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 535.0605 |
| Monoisotopic Mass | 535.0605 |
| Heavy Atoms | 37 |
| Complexity | 1764.4923 |
Chemical Identifiers
| CAS Number | 358353-93-2 |
|---|---|
| SMILES | CC1=C(C(N2C(=O)C(=CC3=CC=C(O3)C4=CC=CC=C4[N+](=O)[O-])SC2=N1)C5=CC=C(C=C5)Cl)C(=O)OC |
Product Overview
AC1MOP99 (CAS 358353-93-2), with molecular formula C26H18ClN3O6S and molecular weight 535.0605 g/mol. IUPAC: methyl 5-(4-chlorophenyl)-7-methyl-2-[[5-(2-nitrophenyl)furan-2-yl]methylidene]-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate.
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