AC1O2I56
(4E)-4-[hydroxy(phenyl)methylidene]-5-(3-methoxyphenyl)-1-(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)pyrrolidine-2,3-dione
Also Known As: (4E)-4-[hydroxy(phenyl)methylidene]-5-(3-methoxyphenyl)-1-(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)pyrrolidine-2,3-dione|(4E)-4-[hydroxy(phenyl)methylidene]-5-(3-methoxyphenyl)-1-[5-(methylsulfanyl)-1,3,4-thiadiazol-2-yl]pyrrolidine-2,3-dione|4-benzoyl-3-hydroxy-5-(3-methoxyphenyl)-1-(5-(methylthio)-1,3,4-thiadiazol-2-yl)-1H-pyrrol-2(5H)-one
| Molecular Formula | C21H17N3O4S2 |
|---|---|
| Molecular Weight | 439.06604 g/mol |
| LogP | 3.8949 |
| Topological Polar Surface Area | 92.62 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 439.06604 |
| Monoisotopic Mass | 439.06604 |
| Heavy Atoms | 30 |
| Complexity | 1143.918 |
Chemical Identifiers
| CAS Number | 897835-48-2 |
|---|---|
| SMILES | COC1=CC=CC(=C1)C2/C(=C(/C3=CC=CC=C3)\O)/C(=O)C(=O)N2C4=NN=C(S4)SC |
Product Overview
AC1O2I56 (CAS 897835-48-2), with molecular formula C21H17N3O4S2 and molecular weight 439.06604 g/mol. IUPAC: (4E)-4-[hydroxy(phenyl)methylidene]-5-(3-methoxyphenyl)-1-(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)pyrrolidine-2,3-dione.
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