3-Amino-1-(2-oxo-2-phenylethyl)pyridin-1-ium bromide
TL;DR: 3-Amino-1-(2-oxo-2-phenylethyl)pyridin-1-ium bromide (CAS 200216-03-1) is a chemical compound with molecular formula C13H13BrN2O and molecular weight 292.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-aminopyridin-1-ium-1-yl)-1-phenylethanone bromide
Also Known As: BIM-0006582.P001, 3-AMINO-1-(2-OXO-2-PHENYLETHYL)PYRIDIN-1-IUM BROMIDE, 3-amino-1-(2-oxo-2-phenylethyl)pyridinium bromide, 2-(3-aminopyridin-1-ium-1-yl)-1-phenylethanone bromide
| Molecular Formula | C13H13BrN2O |
|---|---|
| Molecular Weight | 292.02 g/mol |
| LogP | -1.5568 |
| Topological Polar Surface Area | 46.97 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 292.02112 |
| Heavy Atoms | 17 |
| Complexity | 499.78247 |
Chemical Identifiers
| CAS Number | 200216-03-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)C[N+]2=CC=CC(=C2)N.[Br-] |
Product Overview
3-Amino-1-(2-oxo-2-phenylethyl)pyridin-1-ium bromide (CAS 200216-03-1), with molecular formula C13H13BrN2O and molecular weight 292.02 g/mol. IUPAC: 2-(3-aminopyridin-1-ium-1-yl)-1-phenylethanone bromide.
Chemical Property Profile of 3-Amino-1-(2-oxo-2-phenylethyl)pyridin-1-ium bromide
Property Insights of 3-Amino-1-(2-oxo-2-phenylethyl)pyridin-1-ium bromide
The XLogP value of -1.5568 indicates that 3-Amino-1-(2-oxo-2-phenylethyl)pyridin-1-ium bromide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 46.97 Ų, 3-Amino-1-(2-oxo-2-phenylethyl)pyridin-1-ium bromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Amino-1-(2-oxo-2-phenylethyl)pyridin-1-ium bromide has 1 hydrogen bond donor(s) and 2 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-Amino-1-(2-oxo-2-phenylethyl)pyridin-1-ium bromide?
The CAS number of 3-Amino-1-(2-oxo-2-phenylethyl)pyridin-1-ium bromide is 200216-03-1.
What is the molecular formula of 3-Amino-1-(2-oxo-2-phenylethyl)pyridin-1-ium bromide?
The molecular formula of 3-Amino-1-(2-oxo-2-phenylethyl)pyridin-1-ium bromide is C13H13BrN2O.
What is the molecular weight of 3-Amino-1-(2-oxo-2-phenylethyl)pyridin-1-ium bromide?
The molecular weight of 3-Amino-1-(2-oxo-2-phenylethyl)pyridin-1-ium bromide is 292.02 g/mol.
Where can I buy 3-Amino-1-(2-oxo-2-phenylethyl)pyridin-1-ium bromide?
You can request a quote for 3-Amino-1-(2-oxo-2-phenylethyl)pyridin-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 3-Amino-1-(2-oxo-2-phenylethyl)pyridin-1-ium bromide?
Yes, KEHONG BIO provides custom synthesis services for 3-Amino-1-(2-oxo-2-phenylethyl)pyridin-1-ium bromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.