TL;DR: 2-Pyrrolidinone, 5-ethoxy-1-((4-hydroxyphenyl)sulfonyl)- (CAS 111711-93-4) is a chemical compound with molecular formula C12H15NO5S and molecular weight 285.0671 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-ethoxy-1-(4-hydroxyphenyl)sulfonylpyrrolidin-2-one
Also Known As: 5-Ethoxy-1-((4-hydroxyphenyl)sulfonyl)-2-pyrrolidinone, 2-Pyrrolidinone, 5-ethoxy-1-((4-hydroxyphenyl)sulfonyl)-, 5-ethoxy-1-(4-hydroxyphenylsulfonyl)-2-pyrrolidinone, 5-ethoxy-1-(4-hydroxyphenyl)sulfonylpyrrolidin-2-one, 1-(4-hydroxybenzenesulphonyl)-2-oxo-5-ethoxypyrrolidine
| Molecular Formula | C12H15NO5S |
| Molecular Weight | 285.0671 g/mol |
| XLogP | 0.9 |
| Topological Polar Surface Area (TPSA) | 92.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 285.0671 Da |
| Heavy Atoms | 19 |
| Complexity | 422.0 |
| SMILES | CCOC1CCC(=O)N1S(=O)(=O)C2=CC=C(C=C2)O |
| InChIKey | WYCLOXANJRCQET-UHFFFAOYSA-N |
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Pyrrolidinone, 5-ethoxy-1-((4-hydroxyphenyl)sulfonyl)-. The TPSA of 92.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Pyrrolidinone, 5-ethoxy-1-((4-hydroxyphenyl)sulfonyl)-. Following Lipinski's Rule of Five, 2-Pyrrolidinone, 5-ethoxy-1-((4-hydroxyphenyl)sulfonyl)- has 1 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 2-Pyrrolidinone, 5-ethoxy-1-((4-hydroxyphenyl)sulfonyl)- is 111711-93-4.
The molecular formula of 2-Pyrrolidinone, 5-ethoxy-1-((4-hydroxyphenyl)sulfonyl)- is C12H15NO5S.
The molecular weight of 2-Pyrrolidinone, 5-ethoxy-1-((4-hydroxyphenyl)sulfonyl)- is 285.0671 g/mol.
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