TL;DR: 5-(4-Hydroxy-3-methoxybenzylidene)-3-methyl-2-thioxo-4-imidazolidinone (CAS 1112978-08-1) is a chemical compound with molecular formula C12H12N2O3S and molecular weight 264.05685 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(5Z)-5-[(4-hydroxy-3-methoxyphenyl)methylidene]-3-methyl-2-sulfanylideneimidazolidin-4-one
Also Known As: AB00111765-01, (5Z)-5-(4-hydroxy-3-methoxybenzylidene)-3-methyl-2-thioxoimidazolidin-4-one, 5-(4-hydroxy-3-methoxybenzylidene)-3-methyl-2-thioxo-4-imidazolidinone, (5Z)-5-[(4-hydroxy-3-methoxyphenyl)methylidene]-3-methyl-2-sulfanylideneimidazolidin-4-one
| Molecular Formula | C12H12N2O3S |
| Molecular Weight | 264.05685 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 93.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 264.05685 Da |
| Heavy Atoms | 18 |
| Complexity | 397.0 |
| SMILES | CN1C(=O)/C(=C/C2=CC(=C(C=C2)O)OC)/NC1=S |
| InChIKey | RYSHBQZAFOJVCW-YVMONPNESA-N |
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(4-Hydroxy-3-methoxybenzylidene)-3-methyl-2-thioxo-4-imidazolidinone. The TPSA of 93.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(4-Hydroxy-3-methoxybenzylidene)-3-methyl-2-thioxo-4-imidazolidinone. Following Lipinski's Rule of Five, 5-(4-Hydroxy-3-methoxybenzylidene)-3-methyl-2-thioxo-4-imidazolidinone has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 5-(4-Hydroxy-3-methoxybenzylidene)-3-methyl-2-thioxo-4-imidazolidinone is 1112978-08-1.
The molecular formula of 5-(4-Hydroxy-3-methoxybenzylidene)-3-methyl-2-thioxo-4-imidazolidinone is C12H12N2O3S.
The molecular weight of 5-(4-Hydroxy-3-methoxybenzylidene)-3-methyl-2-thioxo-4-imidazolidinone is 264.05685 g/mol.
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