3-Acetyl-4-phenyl-1-(phenylsulfonyl)pyrrolidin-2-one
TL;DR: 3-Acetyl-4-phenyl-1-(phenylsulfonyl)pyrrolidin-2-one (CAS 5828-59-1) is a chemical compound with molecular formula C18H17NO4S and molecular weight 343.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-acetyl-1-(benzenesulfonyl)-4-phenylpyrrolidin-2-one
Also Known As: 3-acetyl-1-(benzenesulfonyl)-4-phenylpyrrolidin-2-one, 3-acetyl-4-phenyl-1-(phenylsulfonyl)pyrrolidin-2-one
| Molecular Formula | C18H17NO4S |
|---|---|
| Molecular Weight | 343.09 g/mol |
| LogP | 2.2065 |
| Topological Polar Surface Area | 71.52 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 343.08783 |
| Heavy Atoms | 24 |
| Complexity | 862.4065 |
Chemical Identifiers
| CAS Number | 5828-59-1 |
|---|---|
| SMILES | CC(=O)C1C(CN(C1=O)S(=O)(=O)C2=CC=CC=C2)C3=CC=CC=C3 |
Product Overview
3-Acetyl-4-phenyl-1-(phenylsulfonyl)pyrrolidin-2-one (CAS 5828-59-1), with molecular formula C18H17NO4S and molecular weight 343.09 g/mol. IUPAC: 3-acetyl-1-(benzenesulfonyl)-4-phenylpyrrolidin-2-one.
Chemical Property Profile of 3-Acetyl-4-phenyl-1-(phenylsulfonyl)pyrrolidin-2-one
Property Insights of 3-Acetyl-4-phenyl-1-(phenylsulfonyl)pyrrolidin-2-one
The XLogP value of 2.2065 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Acetyl-4-phenyl-1-(phenylsulfonyl)pyrrolidin-2-one. The TPSA of 71.52 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Acetyl-4-phenyl-1-(phenylsulfonyl)pyrrolidin-2-one. Following Lipinski's Rule of Five, 3-Acetyl-4-phenyl-1-(phenylsulfonyl)pyrrolidin-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
Frequently Asked Questions
What is the CAS number of 3-Acetyl-4-phenyl-1-(phenylsulfonyl)pyrrolidin-2-one?
The CAS number of 3-Acetyl-4-phenyl-1-(phenylsulfonyl)pyrrolidin-2-one is 5828-59-1.
What is the molecular formula of 3-Acetyl-4-phenyl-1-(phenylsulfonyl)pyrrolidin-2-one?
The molecular formula of 3-Acetyl-4-phenyl-1-(phenylsulfonyl)pyrrolidin-2-one is C18H17NO4S.
What is the molecular weight of 3-Acetyl-4-phenyl-1-(phenylsulfonyl)pyrrolidin-2-one?
The molecular weight of 3-Acetyl-4-phenyl-1-(phenylsulfonyl)pyrrolidin-2-one is 343.09 g/mol.
Where can I buy 3-Acetyl-4-phenyl-1-(phenylsulfonyl)pyrrolidin-2-one?
You can request a quote for 3-Acetyl-4-phenyl-1-(phenylsulfonyl)pyrrolidin-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Acetyl-4-phenyl-1-(phenylsulfonyl)pyrrolidin-2-one?
Yes, KEHONG BIO provides custom synthesis services for 3-Acetyl-4-phenyl-1-(phenylsulfonyl)pyrrolidin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.