AC1O2VOC
(4E)-1-(6-chloro-1,3-benzothiazol-2-yl)-4-[hydroxy-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-5-(3-methoxy-4-pentoxyphenyl)pyrrolidine-2,3-dione
Also Known As: 1-(6-chlorobenzo[d]thiazol-2-yl)-3-hydroxy-5-(3-methoxy-4-(pentyloxy)phenyl)-4-(2-methyl-2,3-dihydrobenzofuran-5-carbonyl)-1H-pyrrol-2(5H)-one|(4E)-1-(6-chloro-1,3-benzothiazol-2-yl)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-5-[3-methoxy-4-(pentyloxy)phenyl]pyrrolidine-2,3-dione|(4E)-1-(6-chloro-1,3-benzothiazol-2-yl)-4-[hydroxy-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-5-(3-methoxy-4-pentoxyphenyl)pyrrolidine-2,3-dione
| Molecular Formula | C33H31ClN2O6S |
|---|---|
| Molecular Weight | 618.1591 g/mol |
| LogP | 7.477 |
| Topological Polar Surface Area | 98.19 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 618.1591 |
| Monoisotopic Mass | 618.1591 |
| Heavy Atoms | 43 |
| Complexity | 1765.6268 |
Chemical Identifiers
| CAS Number | 893697-84-2 |
|---|---|
| SMILES | CCCCCOC1=C(C=C(C=C1)C2/C(=C(/C3=CC4=C(C=C3)OC(C4)C)\O)/C(=O)C(=O)N2C5=NC6=C(S5)C=C(C=C6)Cl)OC |
Product Overview
AC1O2VOC (CAS 893697-84-2), with molecular formula C33H31ClN2O6S and molecular weight 618.1591 g/mol. IUPAC: (4E)-1-(6-chloro-1,3-benzothiazol-2-yl)-4-[hydroxy-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-5-(3-methoxy-4-pentoxyphenyl)pyrrolidine-2,3-dione.
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