N-phenacylpyridinium bromide
TL;DR: N-phenacylpyridinium bromide (CAS 16883-69-5) is a chemical compound with molecular formula C13H12BrNO and molecular weight 277.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-phenyl-2-pyridin-1-ium-1-ylethanone bromide
Also Known As: 1-Phenacylpyridinium bromide, 1-(2-oxo-2-phenylethyl)pyridin-1-ium bromide, N-Phenacylpyridinium bromide, Phenacylpyridinium Bromide, 1-Phenacylpyridiniumbromide
| Molecular Formula | C13H12BrNO |
|---|---|
| Molecular Weight | 277.01 g/mol |
| LogP | -1.139 |
| Topological Polar Surface Area | 20.95 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 277.01022 |
| Heavy Atoms | 16 |
| Complexity | 442.0045 |
Chemical Identifiers
| CAS Number | 16883-69-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)C[N+]2=CC=CC=C2.[Br-] |
Product Overview
N-phenacylpyridinium bromide (CAS 16883-69-5), with molecular formula C13H12BrNO and molecular weight 277.01 g/mol. IUPAC: 1-phenyl-2-pyridin-1-ium-1-ylethanone bromide.
Chemical Property Profile of N-phenacylpyridinium bromide
Property Insights of N-phenacylpyridinium bromide
The XLogP value of -1.139 indicates that N-phenacylpyridinium bromide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 20.95 Ų, N-phenacylpyridinium bromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-phenacylpyridinium 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 N-phenacylpyridinium bromide?
The CAS number of N-phenacylpyridinium bromide is 16883-69-5.
What is the molecular formula of N-phenacylpyridinium bromide?
The molecular formula of N-phenacylpyridinium bromide is C13H12BrNO.
What is the molecular weight of N-phenacylpyridinium bromide?
The molecular weight of N-phenacylpyridinium bromide is 277.01 g/mol.
Where can I buy N-phenacylpyridinium bromide?
You can request a quote for N-phenacylpyridinium bromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-phenacylpyridinium bromide?
Yes, KEHONG BIO provides custom synthesis services for N-phenacylpyridinium bromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.