1-(Benzenesulfonyl)-5-ethoxypyrrolidin-2-one
TL;DR: 1-(Benzenesulfonyl)-5-ethoxypyrrolidin-2-one (CAS 111711-47-8) is a chemical compound with molecular formula C12H15NO4S and molecular weight 269.07217 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(benzenesulfonyl)-5-ethoxypyrrolidin-2-one
Also Known As: 1-(benzenesulfonyl)-5-ethoxypyrrolidin-2-one, RU 35929, 1-Benzenesulphonyl-2-oxo-5-ethoxypyrrolidine, 5-Ethoxy-1-(phenylsulfonyl)-2-pyrrolidinone, 2-Pyrrolidinone, 5-ethoxy-1-(phenylsulfonyl)-
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C12H15NO4S |
| Molecular Weight | 269.07217 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 72.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 269.07217 Da |
| Heavy Atoms | 18 |
| Complexity | 395.0 |
| SMILES | CCOC1CCC(=O)N1S(=O)(=O)C2=CC=CC=C2 |
| InChIKey | UBENQCMMIVLOTJ-UHFFFAOYSA-N |
Chemical Property Profile of 1-(Benzenesulfonyl)-5-ethoxypyrrolidin-2-one
Property Insights of 1-(Benzenesulfonyl)-5-ethoxypyrrolidin-2-one
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(Benzenesulfonyl)-5-ethoxypyrrolidin-2-one. The TPSA of 72.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(Benzenesulfonyl)-5-ethoxypyrrolidin-2-one. Following Lipinski's Rule of Five, 1-(Benzenesulfonyl)-5-ethoxypyrrolidin-2-one has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-(Benzenesulfonyl)-5-ethoxypyrrolidin-2-one?
The CAS number of 1-(Benzenesulfonyl)-5-ethoxypyrrolidin-2-one is 111711-47-8.
What is the molecular formula of 1-(Benzenesulfonyl)-5-ethoxypyrrolidin-2-one?
The molecular formula of 1-(Benzenesulfonyl)-5-ethoxypyrrolidin-2-one is C12H15NO4S.
What is the molecular weight of 1-(Benzenesulfonyl)-5-ethoxypyrrolidin-2-one?
The molecular weight of 1-(Benzenesulfonyl)-5-ethoxypyrrolidin-2-one is 269.07217 g/mol.
Where can I buy 1-(Benzenesulfonyl)-5-ethoxypyrrolidin-2-one?
You can request a quote for 1-(Benzenesulfonyl)-5-ethoxypyrrolidin-2-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(Benzenesulfonyl)-5-ethoxypyrrolidin-2-one?
Yes, CoreyChem provides custom synthesis services for 1-(Benzenesulfonyl)-5-ethoxypyrrolidin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.