AC1O3B4H
(4E)-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-[hydroxy-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-5-(3-phenylmethoxyphenyl)pyrrolidine-2,3-dione
Also Known As: 5-(3-(benzyloxy)phenyl)-1-(4,6-dimethylbenzo[d]thiazol-2-yl)-3-hydroxy-4-(2-methyl-2,3-dihydrobenzofuran-5-carbonyl)-1H-pyrrol-2(5H)-one|(4E)-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-[hydroxy-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-5-(3-phenylmethoxyphenyl)pyrrolidine-2,3-dione|(4E)-5-[3-(benzyloxy)phenyl]-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]pyrrolidine-2,3-dione
| Molecular Formula | C36H30N2O5S |
|---|---|
| Molecular Weight | 602.18756 g/mol |
| LogP | 7.44184 |
| Topological Polar Surface Area | 88.96 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 602.18756 |
| Monoisotopic Mass | 602.18756 |
| Heavy Atoms | 44 |
| Complexity | 1979.7249 |
Chemical Identifiers
| CAS Number | 893698-07-2 |
|---|---|
| SMILES | CC1CC2=C(O1)C=CC(=C2)/C(=C\3/C(N(C(=O)C3=O)C4=NC5=C(C=C(C=C5S4)C)C)C6=CC(=CC=C6)OCC7=CC=CC=C7)/O |
Product Overview
AC1O3B4H (CAS 893698-07-2), with molecular formula C36H30N2O5S and molecular weight 602.18756 g/mol. IUPAC: (4E)-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-[hydroxy-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-5-(3-phenylmethoxyphenyl)pyrrolidine-2,3-dione.
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