RefChem:1079091
4-[[(5Z)-5-[(4-hydroxy-3-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]methylamino]benzoic acid
Also Known As: Benzoic acid, 4-(((5-((4-hydroxy-3-methoxyphenyl)methylene)-4-oxo-2-thioxo-3-thiazolidinyl)methyl)amino)-|BENZOIC ACID, 4-(((5-((4-HYDROXY-3-METHOXYPHENYL)METHYLENE)-4-OXO-2-THIOXO-3-THI|4-[[(5Z)-5-[(4-hydroxy-3-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]methylamino]benzoic acid
| Molecular Formula | C19H16N2O5S2 |
|---|---|
| Molecular Weight | 416.05005 g/mol |
| LogP | 3.3698 |
| Topological Polar Surface Area | 99.1 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 416.05005 |
| Monoisotopic Mass | 416.05005 |
| Heavy Atoms | 28 |
| Complexity | 972.7893 |
Chemical Identifiers
| CAS Number | 89752-55-6 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)/C=C\2/C(=O)N(C(=S)S2)CNC3=CC=C(C=C3)C(=O)O)O |
Product Overview
RefChem:1079091 (CAS 89752-55-6), with molecular formula C19H16N2O5S2 and molecular weight 416.05005 g/mol. IUPAC: 4-[[(5Z)-5-[(4-hydroxy-3-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]methylamino]benzoic acid.
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