1-(5-Bromopyridin-3-yl)-2-(methylsulfonyl)ethanone
TL;DR: 1-(5-Bromopyridin-3-yl)-2-(methylsulfonyl)ethanone (CAS 386715-50-0) is a chemical compound with molecular formula C8H8BrNO3S and molecular weight 276.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(5-bromo-3-pyridinyl)-2-methylsulfonylethanone
Also Known As: 1-(5-Bromopyridin-3-yl)-2-(methylsulfonyl)ethanone, 1-(5-bromopyridin-3-yl)-2-methylsulfonylethanone, 2232AE, 1-(5-bromopyridin-3-yl)-2-methylsulfonyl-ethanone, 1-(5-bromopyridin-3-yl)-2-methylsulphonylethanone
| Molecular Formula | C8H8BrNO3S |
|---|---|
| Molecular Weight | 276.94 g/mol |
| LogP | 1.0714 |
| Topological Polar Surface Area | 64.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 276.94083 |
| Heavy Atoms | 14 |
| Complexity | 455.40912 |
Chemical Identifiers
| CAS Number | 386715-50-0 |
|---|---|
| SMILES | CS(=O)(=O)CC(=O)C1=CC(=CN=C1)Br |
Product Overview
1-(5-Bromopyridin-3-yl)-2-(methylsulfonyl)ethanone (CAS 386715-50-0), with molecular formula C8H8BrNO3S and molecular weight 276.94 g/mol. IUPAC: 1-(5-bromo-3-pyridinyl)-2-methylsulfonylethanone.
Chemical Property Profile of 1-(5-Bromopyridin-3-yl)-2-(methylsulfonyl)ethanone
Property Insights of 1-(5-Bromopyridin-3-yl)-2-(methylsulfonyl)ethanone
The XLogP value of 1.0714 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(5-Bromopyridin-3-yl)-2-(methylsulfonyl)ethanone. The TPSA of 64.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(5-Bromopyridin-3-yl)-2-(methylsulfonyl)ethanone. Following Lipinski's Rule of Five, 1-(5-Bromopyridin-3-yl)-2-(methylsulfonyl)ethanone 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 1-(5-Bromopyridin-3-yl)-2-(methylsulfonyl)ethanone?
The CAS number of 1-(5-Bromopyridin-3-yl)-2-(methylsulfonyl)ethanone is 386715-50-0.
What is the molecular formula of 1-(5-Bromopyridin-3-yl)-2-(methylsulfonyl)ethanone?
The molecular formula of 1-(5-Bromopyridin-3-yl)-2-(methylsulfonyl)ethanone is C8H8BrNO3S.
What is the molecular weight of 1-(5-Bromopyridin-3-yl)-2-(methylsulfonyl)ethanone?
The molecular weight of 1-(5-Bromopyridin-3-yl)-2-(methylsulfonyl)ethanone is 276.94 g/mol.
Where can I buy 1-(5-Bromopyridin-3-yl)-2-(methylsulfonyl)ethanone?
You can request a quote for 1-(5-Bromopyridin-3-yl)-2-(methylsulfonyl)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(5-Bromopyridin-3-yl)-2-(methylsulfonyl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(5-Bromopyridin-3-yl)-2-(methylsulfonyl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.