2-Amino-5-cyano-6-oxo-1,6-dihydropyridine-3-carboxylic acid
TL;DR: 2-Amino-5-cyano-6-oxo-1,6-dihydropyridine-3-carboxylic acid (CAS 138060-94-3) is a chemical compound with molecular formula C7H5N3O3 and molecular weight 179.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-5-cyano-6-oxo-1H-pyridine-3-carboxylic acid
Also Known As: 2-amino-5-cyano-6-oxo-1,6-dihydropyridine-3-carboxylic acid, 2-amino-5-cyano-6-oxo-1H-pyridine-3-carboxylic Acid, 2-Amino-5-cyano-6-hydroxy-nicotinic acid, Cycloheptanol,2-[(dimethylamino)methyl]-,trans, 2-AMINO-5-CYANO-6-HYDROXYNICOTINIC ACID
| Molecular Formula | C7H5N3O3 |
|---|---|
| Molecular Weight | 179.03 g/mol |
| LogP | -0.47302 |
| Topological Polar Surface Area | 119.97 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 179.0331 |
| Heavy Atoms | 13 |
| Complexity | 455.03107 |
Chemical Identifiers
| CAS Number | 138060-94-3 |
|---|---|
| SMILES | C1=C(C(=O)NC(=C1C(=O)O)N)C#N |
Product Overview
2-Amino-5-cyano-6-oxo-1,6-dihydropyridine-3-carboxylic acid (CAS 138060-94-3), with molecular formula C7H5N3O3 and molecular weight 179.03 g/mol. IUPAC: 2-amino-5-cyano-6-oxo-1H-pyridine-3-carboxylic acid.
Chemical Property Profile of 2-Amino-5-cyano-6-oxo-1,6-dihydropyridine-3-carboxylic acid
Property Insights of 2-Amino-5-cyano-6-oxo-1,6-dihydropyridine-3-carboxylic acid
The XLogP value of -0.47302 indicates that 2-Amino-5-cyano-6-oxo-1,6-dihydropyridine-3-carboxylic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 119.97 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Amino-5-cyano-6-oxo-1,6-dihydropyridine-3-carboxylic acid. Following Lipinski's Rule of Five, 2-Amino-5-cyano-6-oxo-1,6-dihydropyridine-3-carboxylic acid has 3 hydrogen bond donor(s) and 4 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-Amino-5-cyano-6-oxo-1,6-dihydropyridine-3-carboxylic acid?
The CAS number of 2-Amino-5-cyano-6-oxo-1,6-dihydropyridine-3-carboxylic acid is 138060-94-3.
What is the molecular formula of 2-Amino-5-cyano-6-oxo-1,6-dihydropyridine-3-carboxylic acid?
The molecular formula of 2-Amino-5-cyano-6-oxo-1,6-dihydropyridine-3-carboxylic acid is C7H5N3O3.
What is the molecular weight of 2-Amino-5-cyano-6-oxo-1,6-dihydropyridine-3-carboxylic acid?
The molecular weight of 2-Amino-5-cyano-6-oxo-1,6-dihydropyridine-3-carboxylic acid is 179.03 g/mol.
Where can I buy 2-Amino-5-cyano-6-oxo-1,6-dihydropyridine-3-carboxylic acid?
You can request a quote for 2-Amino-5-cyano-6-oxo-1,6-dihydropyridine-3-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Amino-5-cyano-6-oxo-1,6-dihydropyridine-3-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Amino-5-cyano-6-oxo-1,6-dihydropyridine-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.