AC1NYKJR
(4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-(3-methoxyphenyl)-1-(6-methyl-1,3-benzothiazol-2-yl)pyrrolidine-2,3-dione
Also Known As: (4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-(3-methoxyphenyl)-1-(6-methyl-1,3-benzothiazol-2-yl)pyrrolidine-2,3-dione|4-(2,3-dihydrobenzo[b][1,4]dioxine-6-carbonyl)-3-hydroxy-5-(3-methoxyphenyl)-1-(6-methylbenzo[d]thiazol-2-yl)-1H-pyrrol-2(5H)-one
| Molecular Formula | C28H22N2O6S |
|---|---|
| Molecular Weight | 514.1199 g/mol |
| LogP | 5.01082 |
| Topological Polar Surface Area | 98.19 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 514.1199 |
| Monoisotopic Mass | 514.1199 |
| Heavy Atoms | 37 |
| Complexity | 1607.5228 |
Chemical Identifiers
| CAS Number | 573695-75-7 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)N=C(S2)N3C(/C(=C(/C4=CC5=C(C=C4)OCCO5)\O)/C(=O)C3=O)C6=CC(=CC=C6)OC |
Product Overview
AC1NYKJR (CAS 573695-75-7), with molecular formula C28H22N2O6S and molecular weight 514.1199 g/mol. IUPAC: (4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-(3-methoxyphenyl)-1-(6-methyl-1,3-benzothiazol-2-yl)pyrrolidine-2,3-dione.
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