TL;DR: 2-Pyrrolidinone, 1-((2-(4-methoxyphenyl)ethenyl)sulfonyl)-5-(1-methylethoxy)- (CAS 114485-84-6) is a chemical compound with molecular formula C16H21NO5S and molecular weight 339.11404 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[(E)-2-(4-methoxyphenyl)ethenyl]sulfonyl-5-propan-2-yloxypyrrolidin-2-one
Also Known As: 1-(4-Methoxystyrenesulphonyl)-2-oxo-5-isopropoxypyrrolidine, 1-((2-(4-Methoxyphenyl)ethenyl)sulfonyl)-5-(1-methylethoxy)-2-pyrrolidinone, 2-Pyrrolidinone, 1-((2-(4-methoxyphenyl)ethenyl)sulfonyl)-5-(1-methylethoxy)-, 1-[(E)-2-(4-methoxyphenyl)ethenyl]sulfonyl-5-propan-2-yloxypyrrolidin-2-one
| Molecular Formula | C16H21NO5S |
| Molecular Weight | 339.11404 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 81.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 339.11404 Da |
| Heavy Atoms | 23 |
| Complexity | 529.0 |
| SMILES | CC(C)OC1CCC(=O)N1S(=O)(=O)/C=C/C2=CC=C(C=C2)OC |
| InChIKey | MJASDBVCPSZISI-ZHACJKMWSA-N |
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Pyrrolidinone, 1-((2-(4-methoxyphenyl)ethenyl)sulfonyl)-5-(1-methylethoxy)-. The TPSA of 81.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Pyrrolidinone, 1-((2-(4-methoxyphenyl)ethenyl)sulfonyl)-5-(1-methylethoxy)-. Following Lipinski's Rule of Five, 2-Pyrrolidinone, 1-((2-(4-methoxyphenyl)ethenyl)sulfonyl)-5-(1-methylethoxy)- has 0 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, 1-((2-(4-methoxyphenyl)ethenyl)sulfonyl)-5-(1-methylethoxy)- is 114485-84-6.
The molecular formula of 2-Pyrrolidinone, 1-((2-(4-methoxyphenyl)ethenyl)sulfonyl)-5-(1-methylethoxy)- is C16H21NO5S.
The molecular weight of 2-Pyrrolidinone, 1-((2-(4-methoxyphenyl)ethenyl)sulfonyl)-5-(1-methylethoxy)- is 339.11404 g/mol.
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