6-Methyl-1-(3-nitroanilino)-4-oxo-1,4-dihydro-3-pyridinecarboxylic acid
TL;DR: 6-Methyl-1-(3-nitroanilino)-4-oxo-1,4-dihydro-3-pyridinecarboxylic acid (CAS 477886-67-2) is a chemical compound with molecular formula C13H11N3O5 and molecular weight 289.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-methyl-1-(3-nitroanilino)-4-oxopyridine-3-carboxylic acid
Also Known As: 6-methyl-1-(3-nitroanilino)-4-oxo-1,4-dihydro-3-pyridinecarboxylic acid, 2M-716, 6-methyl-1-(3-nitroanilino)-4-oxopyridine-3-carboxylic acid, 6-methyl-1-[(3-nitrophenyl)amino]-4-oxo-1,4-dihydropyridine-3-carboxylic acid, 6-methyl-1-(3-nitroanilino)-4-oxo-pyridine-3-carboxylic acid
| Molecular Formula | C13H11N3O5 |
|---|---|
| Molecular Weight | 289.07 g/mol |
| LogP | 1.63832 |
| Topological Polar Surface Area | 114.47 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 289.0699 |
| Heavy Atoms | 21 |
| Complexity | 781.61646 |
Chemical Identifiers
| CAS Number | 477886-67-2 |
|---|---|
| SMILES | CC1=CC(=O)C(=CN1NC2=CC(=CC=C2)[N+](=O)[O-])C(=O)O |
Product Overview
6-Methyl-1-(3-nitroanilino)-4-oxo-1,4-dihydro-3-pyridinecarboxylic acid (CAS 477886-67-2), with molecular formula C13H11N3O5 and molecular weight 289.07 g/mol. IUPAC: 6-methyl-1-(3-nitroanilino)-4-oxopyridine-3-carboxylic acid.
Chemical Property Profile of 6-Methyl-1-(3-nitroanilino)-4-oxo-1,4-dihydro-3-pyridinecarboxylic acid
Property Insights of 6-Methyl-1-(3-nitroanilino)-4-oxo-1,4-dihydro-3-pyridinecarboxylic acid
The XLogP value of 1.63832 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Methyl-1-(3-nitroanilino)-4-oxo-1,4-dihydro-3-pyridinecarboxylic acid. The TPSA of 114.47 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Methyl-1-(3-nitroanilino)-4-oxo-1,4-dihydro-3-pyridinecarboxylic acid. Following Lipinski's Rule of Five, 6-Methyl-1-(3-nitroanilino)-4-oxo-1,4-dihydro-3-pyridinecarboxylic acid has 2 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 6-Methyl-1-(3-nitroanilino)-4-oxo-1,4-dihydro-3-pyridinecarboxylic acid?
The CAS number of 6-Methyl-1-(3-nitroanilino)-4-oxo-1,4-dihydro-3-pyridinecarboxylic acid is 477886-67-2.
What is the molecular formula of 6-Methyl-1-(3-nitroanilino)-4-oxo-1,4-dihydro-3-pyridinecarboxylic acid?
The molecular formula of 6-Methyl-1-(3-nitroanilino)-4-oxo-1,4-dihydro-3-pyridinecarboxylic acid is C13H11N3O5.
What is the molecular weight of 6-Methyl-1-(3-nitroanilino)-4-oxo-1,4-dihydro-3-pyridinecarboxylic acid?
The molecular weight of 6-Methyl-1-(3-nitroanilino)-4-oxo-1,4-dihydro-3-pyridinecarboxylic acid is 289.07 g/mol.
Where can I buy 6-Methyl-1-(3-nitroanilino)-4-oxo-1,4-dihydro-3-pyridinecarboxylic acid?
You can request a quote for 6-Methyl-1-(3-nitroanilino)-4-oxo-1,4-dihydro-3-pyridinecarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Methyl-1-(3-nitroanilino)-4-oxo-1,4-dihydro-3-pyridinecarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 6-Methyl-1-(3-nitroanilino)-4-oxo-1,4-dihydro-3-pyridinecarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.