3-Amino-5-pyridin-1-ium-1-ylpyrazine-2,6-dicarbonitrile chloride
TL;DR: 3-Amino-5-pyridin-1-ium-1-ylpyrazine-2,6-dicarbonitrile chloride (CAS 53853-53-5) is a chemical compound with molecular formula C11H7ClN6 and molecular weight 258.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-amino-5-pyridin-1-ium-1-ylpyrazine-2,6-dicarbonitrile chloride
Also Known As: 1-(6-Amino-3,5-dicyano-pyrazin-2-yl)-pyridinium chloride, 3-amino-5-pyridin-1-yl-pyrazine-2,6-dicarbonitrile Chloride, 3-amino-5-pyridin-1-ium-1-ylpyrazine-2,6-dicarbonitrile chloride
| Molecular Formula | C11H7ClN6 |
|---|---|
| Molecular Weight | 258.04 g/mol |
| LogP | -2.91714 |
| Topological Polar Surface Area | 103.26 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 258.04208 |
| Heavy Atoms | 18 |
| Complexity | 641.0635 |
Chemical Identifiers
| CAS Number | 53853-53-5 |
|---|---|
| SMILES | C1=CC=[N+](C=C1)C2=NC(=C(N=C2C#N)C#N)N.[Cl-] |
Product Overview
3-Amino-5-pyridin-1-ium-1-ylpyrazine-2,6-dicarbonitrile chloride (CAS 53853-53-5), with molecular formula C11H7ClN6 and molecular weight 258.04 g/mol. IUPAC: 3-amino-5-pyridin-1-ium-1-ylpyrazine-2,6-dicarbonitrile chloride.
Chemical Property Profile of 3-Amino-5-pyridin-1-ium-1-ylpyrazine-2,6-dicarbonitrile chloride
Property Insights of 3-Amino-5-pyridin-1-ium-1-ylpyrazine-2,6-dicarbonitrile chloride
The XLogP value of -2.91714 indicates that 3-Amino-5-pyridin-1-ium-1-ylpyrazine-2,6-dicarbonitrile chloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 103.26 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Amino-5-pyridin-1-ium-1-ylpyrazine-2,6-dicarbonitrile chloride. Following Lipinski's Rule of Five, 3-Amino-5-pyridin-1-ium-1-ylpyrazine-2,6-dicarbonitrile chloride has 1 hydrogen bond donor(s) and 5 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-5-pyridin-1-ium-1-ylpyrazine-2,6-dicarbonitrile chloride?
The CAS number of 3-Amino-5-pyridin-1-ium-1-ylpyrazine-2,6-dicarbonitrile chloride is 53853-53-5.
What is the molecular formula of 3-Amino-5-pyridin-1-ium-1-ylpyrazine-2,6-dicarbonitrile chloride?
The molecular formula of 3-Amino-5-pyridin-1-ium-1-ylpyrazine-2,6-dicarbonitrile chloride is C11H7ClN6.
What is the molecular weight of 3-Amino-5-pyridin-1-ium-1-ylpyrazine-2,6-dicarbonitrile chloride?
The molecular weight of 3-Amino-5-pyridin-1-ium-1-ylpyrazine-2,6-dicarbonitrile chloride is 258.04 g/mol.
Where can I buy 3-Amino-5-pyridin-1-ium-1-ylpyrazine-2,6-dicarbonitrile chloride?
You can request a quote for 3-Amino-5-pyridin-1-ium-1-ylpyrazine-2,6-dicarbonitrile chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Amino-5-pyridin-1-ium-1-ylpyrazine-2,6-dicarbonitrile chloride?
Yes, KEHONG BIO provides custom synthesis services for 3-Amino-5-pyridin-1-ium-1-ylpyrazine-2,6-dicarbonitrile chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.