1-(2-(4-Chlorophenyl)-2-oxoethyl)-2,3-dimethylpyridin-1-ium bromide
TL;DR: 1-(2-(4-Chlorophenyl)-2-oxoethyl)-2,3-dimethylpyridin-1-ium bromide (CAS 202202-50-4) is a chemical compound with molecular formula C15H15BrClNO and molecular weight 339.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-chlorophenyl)-2-(2,3-dimethylpyridin-1-ium-1-yl)ethanone bromide
Also Known As: BIM-0021263.P001, 1-(2-(4-chlorophenyl)-2-oxoethyl)-2,3-dimethylpyridin-1-ium bromide, 1-(4-chlorophenyl)-2-(2,3-dimethylpyridin-1-ium-1-yl)ethanone bromide, 1-(4-chlorophenyl)-2-(2,3-dimethylpyridin-1-ium-1-yl)ethanone;bromide
| Molecular Formula | C15H15BrClNO |
|---|---|
| Molecular Weight | 339.00 g/mol |
| LogP | 0.13124 |
| Topological Polar Surface Area | 20.95 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 339.00256 |
| Heavy Atoms | 19 |
| Complexity | 581.19946 |
Chemical Identifiers
| CAS Number | 202202-50-4 |
|---|---|
| SMILES | CC1=C([N+](=CC=C1)CC(=O)C2=CC=C(C=C2)Cl)C.[Br-] |
Product Overview
1-(2-(4-Chlorophenyl)-2-oxoethyl)-2,3-dimethylpyridin-1-ium bromide (CAS 202202-50-4), with molecular formula C15H15BrClNO and molecular weight 339.00 g/mol. IUPAC: 1-(4-chlorophenyl)-2-(2,3-dimethylpyridin-1-ium-1-yl)ethanone bromide.
Chemical Property Profile of 1-(2-(4-Chlorophenyl)-2-oxoethyl)-2,3-dimethylpyridin-1-ium bromide
Property Insights of 1-(2-(4-Chlorophenyl)-2-oxoethyl)-2,3-dimethylpyridin-1-ium bromide
The XLogP value of 0.13124 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2-(4-Chlorophenyl)-2-oxoethyl)-2,3-dimethylpyridin-1-ium bromide. With a topological polar surface area (TPSA) of 20.95 Ų, 1-(2-(4-Chlorophenyl)-2-oxoethyl)-2,3-dimethylpyridin-1-ium bromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2-(4-Chlorophenyl)-2-oxoethyl)-2,3-dimethylpyridin-1-ium bromide has 0 hydrogen bond donor(s) and 1 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-(2-(4-Chlorophenyl)-2-oxoethyl)-2,3-dimethylpyridin-1-ium bromide?
The CAS number of 1-(2-(4-Chlorophenyl)-2-oxoethyl)-2,3-dimethylpyridin-1-ium bromide is 202202-50-4.
What is the molecular formula of 1-(2-(4-Chlorophenyl)-2-oxoethyl)-2,3-dimethylpyridin-1-ium bromide?
The molecular formula of 1-(2-(4-Chlorophenyl)-2-oxoethyl)-2,3-dimethylpyridin-1-ium bromide is C15H15BrClNO.
What is the molecular weight of 1-(2-(4-Chlorophenyl)-2-oxoethyl)-2,3-dimethylpyridin-1-ium bromide?
The molecular weight of 1-(2-(4-Chlorophenyl)-2-oxoethyl)-2,3-dimethylpyridin-1-ium bromide is 339.00 g/mol.
Where can I buy 1-(2-(4-Chlorophenyl)-2-oxoethyl)-2,3-dimethylpyridin-1-ium bromide?
You can request a quote for 1-(2-(4-Chlorophenyl)-2-oxoethyl)-2,3-dimethylpyridin-1-ium bromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-(4-Chlorophenyl)-2-oxoethyl)-2,3-dimethylpyridin-1-ium bromide?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-(4-Chlorophenyl)-2-oxoethyl)-2,3-dimethylpyridin-1-ium bromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.