TL;DR: (5Z)-5-(3-hydroxy-4-methoxybenzylidene)-1,3-thiazolidine-2,4-dione (CAS 1039559-01-7) is a chemical compound with molecular formula C11H9NO4S and molecular weight 251.02522 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(5Z)-5-[(3-hydroxy-4-methoxyphenyl)methylidene]-1,3-thiazolidine-2,4-dione
Also Known As: (Z)-5-(3-hydroxy-4-methoxybenzylidene)thiazolidine-2,4-dione, (5Z)-5-(3-hydroxy-4-methoxybenzylidene)-1,3-thiazolidine-2,4-dione, 2,4-Thiazolidinedione, 5-[(3-hydroxy-4-methoxyphenyl)methylene]-, (5Z)-5-[(3-hydroxy-4-methoxyphenyl)methylidene]-1,3-thiazolidine-2,4-dione, 5-[(E)-(3-hydroxy-4-methoxyphenyl)methylidene]-1,3-thiazolane-2,4-dione
| Molecular Formula | C11H9NO4S |
| Molecular Weight | 251.02522 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 101.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 251.02522 Da |
| Heavy Atoms | 17 |
| Complexity | 368.0 |
| SMILES | COC1=C(C=C(C=C1)/C=C\2/C(=O)NC(=O)S2)O |
| InChIKey | MHRJJGJJVMGLRQ-UITAMQMPSA-N |
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (5Z)-5-(3-hydroxy-4-methoxybenzylidene)-1,3-thiazolidine-2,4-dione. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (5Z)-5-(3-hydroxy-4-methoxybenzylidene)-1,3-thiazolidine-2,4-dione. Following Lipinski's Rule of Five, (5Z)-5-(3-hydroxy-4-methoxybenzylidene)-1,3-thiazolidine-2,4-dione has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (5Z)-5-(3-hydroxy-4-methoxybenzylidene)-1,3-thiazolidine-2,4-dione is 1039559-01-7.
The molecular formula of (5Z)-5-(3-hydroxy-4-methoxybenzylidene)-1,3-thiazolidine-2,4-dione is C11H9NO4S.
The molecular weight of (5Z)-5-(3-hydroxy-4-methoxybenzylidene)-1,3-thiazolidine-2,4-dione is 251.02522 g/mol.
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