![1-[(5-Bromo-2-methoxy-4-methylphenyl)sulfonyl]pyrrolidine structure](/static/products/7945/794548-44-0.webp)
1-[(5-Bromo-2-methoxy-4-methylphenyl)sulfonyl]pyrrolidine
TL;DR: 1-[(5-Bromo-2-methoxy-4-methylphenyl)sulfonyl]pyrrolidine (CAS 794548-44-0) is a chemical compound with molecular formula C12H16BrNO3S and molecular weight 333.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(5-bromo-2-methoxy-4-methylphenyl)sulfonylpyrrolidine
Also Known As: 1-[(5-bromo-2-methoxy-4-methylphenyl)sulfonyl]pyrrolidine, 1-(5-bromo-2-methoxy-4-methylphenyl)sulfonylpyrrolidine, AP-263/43241408, 5-bromo-2-methoxy-4-methyl-1-(pyrrolidinylsulfonyl)benzene, 4-bromo-5-methyl-2-(1-pyrrolidinylsulfonyl)phenyl methyl ether
| Molecular Formula | C12H16BrNO3S |
|---|---|
| Molecular Weight | 333.00 g/mol |
| LogP | 2.55062 |
| Topological Polar Surface Area | 46.61 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 333.00342 |
| Heavy Atoms | 18 |
| Complexity | 550.6861 |
Chemical Identifiers
| CAS Number | 794548-44-0 |
|---|---|
| SMILES | CC1=CC(=C(C=C1Br)S(=O)(=O)N2CCCC2)OC |
Product Overview
1-[(5-Bromo-2-methoxy-4-methylphenyl)sulfonyl]pyrrolidine (CAS 794548-44-0), with molecular formula C12H16BrNO3S and molecular weight 333.00 g/mol. IUPAC: 1-(5-bromo-2-methoxy-4-methylphenyl)sulfonylpyrrolidine.
Chemical Property Profile of 1-[(5-Bromo-2-methoxy-4-methylphenyl)sulfonyl]pyrrolidine
Property Insights of 1-[(5-Bromo-2-methoxy-4-methylphenyl)sulfonyl]pyrrolidine
The XLogP value of 2.55062 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[(5-Bromo-2-methoxy-4-methylphenyl)sulfonyl]pyrrolidine. With a topological polar surface area (TPSA) of 46.61 Ų, 1-[(5-Bromo-2-methoxy-4-methylphenyl)sulfonyl]pyrrolidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[(5-Bromo-2-methoxy-4-methylphenyl)sulfonyl]pyrrolidine has 0 hydrogen bond donor(s) and 3 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 1-[(5-Bromo-2-methoxy-4-methylphenyl)sulfonyl]pyrrolidine?
The CAS number of 1-[(5-Bromo-2-methoxy-4-methylphenyl)sulfonyl]pyrrolidine is 794548-44-0.
What is the molecular formula of 1-[(5-Bromo-2-methoxy-4-methylphenyl)sulfonyl]pyrrolidine?
The molecular formula of 1-[(5-Bromo-2-methoxy-4-methylphenyl)sulfonyl]pyrrolidine is C12H16BrNO3S.
What is the molecular weight of 1-[(5-Bromo-2-methoxy-4-methylphenyl)sulfonyl]pyrrolidine?
The molecular weight of 1-[(5-Bromo-2-methoxy-4-methylphenyl)sulfonyl]pyrrolidine is 333.00 g/mol.
Where can I buy 1-[(5-Bromo-2-methoxy-4-methylphenyl)sulfonyl]pyrrolidine?
You can request a quote for 1-[(5-Bromo-2-methoxy-4-methylphenyl)sulfonyl]pyrrolidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(5-Bromo-2-methoxy-4-methylphenyl)sulfonyl]pyrrolidine?
Yes, KEHONG BIO provides custom synthesis services for 1-[(5-Bromo-2-methoxy-4-methylphenyl)sulfonyl]pyrrolidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.