TL;DR: 2-Pyrrolidinone, 5-ethoxy-1-(1-naphthalenylsulfonyl)- (CAS 111711-64-9) is a chemical compound with molecular formula C16H17NO4S and molecular weight 319.08783 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-ethoxy-1-naphthalen-1-ylsulfonylpyrrolidin-2-one
Also Known As: 5-Ethoxy-1-(1-naphthalenylsulfonyl)-2-pyrrolidinone, 2-Pyrrolidinone, 5-ethoxy-1-(1-naphthalenylsulfonyl)-, 5-Ethoxy-1-(1-naphthylsulfonyl)pyrrolidin-2-one, 5-ethoxy-1-naphthalen-1-ylsulfonylpyrrolidin-2-one, 5-ETHOXY-1-(NAPHTHALENE-1-SULFONYL)PYRROLIDIN-2-ONE
| Molecular Formula | C16H17NO4S |
| Molecular Weight | 319.08783 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 72.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 319.08783 Da |
| Heavy Atoms | 22 |
| Complexity | 513.0 |
| SMILES | CCOC1CCC(=O)N1S(=O)(=O)C2=CC=CC3=CC=CC=C32 |
| InChIKey | WWVLYILNKVYSJU-UHFFFAOYSA-N |
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Pyrrolidinone, 5-ethoxy-1-(1-naphthalenylsulfonyl)-. The TPSA of 72.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Pyrrolidinone, 5-ethoxy-1-(1-naphthalenylsulfonyl)-. Following Lipinski's Rule of Five, 2-Pyrrolidinone, 5-ethoxy-1-(1-naphthalenylsulfonyl)- has 0 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 2-Pyrrolidinone, 5-ethoxy-1-(1-naphthalenylsulfonyl)- is 111711-64-9.
The molecular formula of 2-Pyrrolidinone, 5-ethoxy-1-(1-naphthalenylsulfonyl)- is C16H17NO4S.
The molecular weight of 2-Pyrrolidinone, 5-ethoxy-1-(1-naphthalenylsulfonyl)- is 319.08783 g/mol.
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