TL;DR: 5-(m-Hydroxybenzylidene)rhodanine (CAS 1064365-95-2) is a chemical compound with molecular formula C10H7NO2S2 and molecular weight 236.99182 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-[(3-hydroxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: 5-(m-Hydroxybenzylidene)rhodanine, (5E)-5-(3-hydroxybenzylidene)-2-mercapto-1,3-thiazol-4(5H)-one, 5-[(3-hydroxyphenyl)methylene]-2-sulfanyl-thiazol-4-one, (5E)-5-[(3-hydroxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one, (5Z)-5-[(3-Hydroxyphenyl)methylene]-2-thioxo-thiazolidin-4-one
| Molecular Formula | C10H7NO2S2 |
| Molecular Weight | 236.99182 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 107.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 236.99182 Da |
| Heavy Atoms | 15 |
| Complexity | 327.0 |
| SMILES | C1=CC(=CC(=C1)O)C=C2C(=O)NC(=S)S2 |
| InChIKey | ZCQNEHSJTBPNPT-UHFFFAOYSA-N |
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(m-Hydroxybenzylidene)rhodanine. The TPSA of 107.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(m-Hydroxybenzylidene)rhodanine. Following Lipinski's Rule of Five, 5-(m-Hydroxybenzylidene)rhodanine 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-(m-Hydroxybenzylidene)rhodanine is 1064365-95-2.
The molecular formula of 5-(m-Hydroxybenzylidene)rhodanine is C10H7NO2S2.
The molecular weight of 5-(m-Hydroxybenzylidene)rhodanine is 236.99182 g/mol.
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