![2-(4-Cyanophenyl)-1-methyl-3-nitroimidazo[1,2-a]pyridin-1-ium structure](/static/products/1027/1027340-72-2.webp)
2-(4-Cyanophenyl)-1-methyl-3-nitroimidazo[1,2-a]pyridin-1-ium
TL;DR: 2-(4-Cyanophenyl)-1-methyl-3-nitroimidazo[1,2-a]pyridin-1-ium (CAS 1027340-72-2) is a chemical compound with molecular formula C15H11N4O2+ and molecular weight 279.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(1-methyl-3-nitroimidazo[1,2-a]pyridin-1-ium-2-yl)benzonitrile
Also Known As: 2-(4-cyanophenyl)-1-methyl-3-nitroimidazo[1,2-a]pyridin-1-ium, AQ-776/42801714, 4-(1-methyl-3-nitroimidazo[1,2-a]pyridin-4-ium-2-yl)benzonitrile
| Molecular Formula | C15H11N4O2+ |
|---|---|
| Molecular Weight | 279.09 g/mol |
| LogP | 2.21068 |
| Topological Polar Surface Area | 75.22 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 279.0882 |
| Heavy Atoms | 21 |
| Complexity | 888.4179 |
Chemical Identifiers
| CAS Number | 1027340-72-2 |
|---|---|
| SMILES | C[N+]1=C2C=CC=CN2C(=C1C3=CC=C(C=C3)C#N)[N+](=O)[O-] |
Product Overview
2-(4-Cyanophenyl)-1-methyl-3-nitroimidazo[1,2-a]pyridin-1-ium (CAS 1027340-72-2), with molecular formula C15H11N4O2+ and molecular weight 279.09 g/mol. IUPAC: 4-(1-methyl-3-nitroimidazo[1,2-a]pyridin-1-ium-2-yl)benzonitrile.
Chemical Property Profile of 2-(4-Cyanophenyl)-1-methyl-3-nitroimidazo[1,2-a]pyridin-1-ium
Property Insights of 2-(4-Cyanophenyl)-1-methyl-3-nitroimidazo[1,2-a]pyridin-1-ium
The XLogP value of 2.21068 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-Cyanophenyl)-1-methyl-3-nitroimidazo[1,2-a]pyridin-1-ium. The TPSA of 75.22 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-Cyanophenyl)-1-methyl-3-nitroimidazo[1,2-a]pyridin-1-ium. Following Lipinski's Rule of Five, 2-(4-Cyanophenyl)-1-methyl-3-nitroimidazo[1,2-a]pyridin-1-ium has 0 hydrogen bond donor(s) and 3 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 2-(4-Cyanophenyl)-1-methyl-3-nitroimidazo[1,2-a]pyridin-1-ium?
The CAS number of 2-(4-Cyanophenyl)-1-methyl-3-nitroimidazo[1,2-a]pyridin-1-ium is 1027340-72-2.
What is the molecular formula of 2-(4-Cyanophenyl)-1-methyl-3-nitroimidazo[1,2-a]pyridin-1-ium?
The molecular formula of 2-(4-Cyanophenyl)-1-methyl-3-nitroimidazo[1,2-a]pyridin-1-ium is C15H11N4O2+.
What is the molecular weight of 2-(4-Cyanophenyl)-1-methyl-3-nitroimidazo[1,2-a]pyridin-1-ium?
The molecular weight of 2-(4-Cyanophenyl)-1-methyl-3-nitroimidazo[1,2-a]pyridin-1-ium is 279.09 g/mol.
Where can I buy 2-(4-Cyanophenyl)-1-methyl-3-nitroimidazo[1,2-a]pyridin-1-ium?
You can request a quote for 2-(4-Cyanophenyl)-1-methyl-3-nitroimidazo[1,2-a]pyridin-1-ium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Cyanophenyl)-1-methyl-3-nitroimidazo[1,2-a]pyridin-1-ium?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Cyanophenyl)-1-methyl-3-nitroimidazo[1,2-a]pyridin-1-ium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.