RefChem:1097325
TL;DR: RefChem:1097325 (CAS 2852-27-9) is a chemical compound with molecular formula C26H22Br2N2O4 and molecular weight 583.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-hydroxypyridin-1-ium-1-yl)-1-[4-[4-[2-(3-hydroxypyridin-1-ium-1-yl)acetyl]phenyl]phenyl]ethanone dibromide
Also Known As: KST-1B2701, 1,1'-(4,4'-Biphenylenebis(carbonylmethylene))bis(3-hydroxypyridinium bromide), Pyridinium, 1,1'-(4,4'-biphenylenebis(carbonylmethylene))bis(3-hydroxy-, dibromide, 1,1'-[biphenyl-4,4'-diylbis(2-oxoethane-2,1-diyl)]bis(3-hydroxypyridinium) dibromide, 2-(3-hydroxypyridin-1-ium-1-yl)-1-[4-[4-[2-(3-hydroxypyridin-1-ium-1-yl)acetyl]phenyl]phenyl]ethanone dibromide
| Molecular Formula | C26H22Br2N2O4 |
|---|---|
| Molecular Weight | 583.99 g/mol |
| LogP | -2.8864 |
| Topological Polar Surface Area | 82.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 583.9946 |
| Heavy Atoms | 34 |
| Complexity | 571.0 |
Chemical Identifiers
| CAS Number | 2852-27-9 |
|---|---|
| SMILES | C1=CC(=C[N+](=C1)CC(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)C(=O)C[N+]4=CC=CC(=C4)O)O.[Br-].[Br-] |
| InChIKey | VCKOQDOTPSVUIU-UHFFFAOYSA-N |
Product Overview
RefChem:1097325 (CAS 2852-27-9), with molecular formula C26H22Br2N2O4 and molecular weight 583.99 g/mol. IUPAC: 2-(3-hydroxypyridin-1-ium-1-yl)-1-[4-[4-[2-(3-hydroxypyridin-1-ium-1-yl)acetyl]phenyl]phenyl]ethanone dibromide.
Chemical Property Profile of RefChem:1097325
Property Insights of RefChem:1097325
The XLogP value of -2.8864 indicates that RefChem:1097325 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 82.4 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1097325. Following Lipinski's Rule of Five, RefChem:1097325 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:1097325?
The CAS number of RefChem:1097325 is 2852-27-9.
What is the molecular formula of RefChem:1097325?
The molecular formula of RefChem:1097325 is C26H22Br2N2O4.
What is the molecular weight of RefChem:1097325?
The molecular weight of RefChem:1097325 is 583.99 g/mol.
Where can I buy RefChem:1097325?
You can request a quote for RefChem:1097325 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1097325?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1097325 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.