AC1NZZKJ
3-[(5Z)-5-[(4-octoxyphenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]propanoic acid
Also Known As: 3-{(5Z)-5-[4-(octyloxy)benzylidene]-2,4-dioxo-1,3-thiazolidin-3-yl}propanoic acid|(Z)-3-(5-(4-(octyloxy)benzylidene)-2,4-dioxothiazolidin-3-yl)propanoic acid|3-[(5Z)-5-[(4-octoxyphenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]propanoic acid|3-[5-[(4-octoxyphenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]propanoic Acid|3-{5-[(4-octyloxyphenyl)methylene]-2,4-dioxo-1,3-thiazolidin-3-yl}propanoic ac id
| Molecular Formula | C21H27NO5S |
|---|---|
| Molecular Weight | 405.16098 g/mol |
| LogP | 4.9369 |
| Topological Polar Surface Area | 83.91 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 12 |
| Exact Mass | 405.16098 |
| Monoisotopic Mass | 405.16098 |
| Heavy Atoms | 28 |
| Complexity | 714.01105 |
Chemical Identifiers
| CAS Number | 844654-53-1 |
|---|---|
| SMILES | CCCCCCCCOC1=CC=C(C=C1)/C=C\2/C(=O)N(C(=O)S2)CCC(=O)O |
Product Overview
AC1NZZKJ (CAS 844654-53-1), with molecular formula C21H27NO5S and molecular weight 405.16098 g/mol. IUPAC: 3-[(5Z)-5-[(4-octoxyphenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]propanoic acid.
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