AC1NYC0S
(4E)-1-(6-fluoro-1,3-benzothiazol-2-yl)-4-[hydroxy-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-5-(3-nitrophenyl)pyrrolidine-2,3-dione
Also Known As: (4E)-1-(6-fluoro-1,3-benzothiazol-2-yl)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-5-(3-nitrophenyl)pyrrolidine-2,3-dione|(4E)-1-(6-fluoro-1,3-benzothiazol-2-yl)-4-[hydroxy-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-5-(3-nitrophenyl)pyrrolidine-2,3-dione|1-(6-fluorobenzo[d]thiazol-2-yl)-3-hydroxy-4-(2-methyl-2,3-dihydrobenzofuran-5-carbonyl)-5-(3-nitrophenyl)-1H-pyrrol-2(5H)-one
| Molecular Formula | C27H18FN3O6S |
|---|---|
| Molecular Weight | 531.09 g/mol |
| LogP | 5.2933 |
| Topological Polar Surface Area | 122.87 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 531.09 |
| Monoisotopic Mass | 531.09 |
| Heavy Atoms | 38 |
| Complexity | 1714.2136 |
Chemical Identifiers
| CAS Number | 877784-16-2 |
|---|---|
| SMILES | CC1CC2=C(O1)C=CC(=C2)/C(=C\3/C(N(C(=O)C3=O)C4=NC5=C(S4)C=C(C=C5)F)C6=CC(=CC=C6)[N+](=O)[O-])/O |
Product Overview
AC1NYC0S (CAS 877784-16-2), with molecular formula C27H18FN3O6S and molecular weight 531.09 g/mol. IUPAC: (4E)-1-(6-fluoro-1,3-benzothiazol-2-yl)-4-[hydroxy-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-5-(3-nitrophenyl)pyrrolidine-2,3-dione.