4-Methyl-5-nitro-1,2-dihydropyridin-2-one
TL;DR: 4-Methyl-5-nitro-1,2-dihydropyridin-2-one (CAS 21901-41-7) is a chemical compound with molecular formula C6H6N2O3 and molecular weight 154.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-5-nitro-1H-pyridin-2-one
Also Known As: 2-Hydroxy-4-methyl-5-nitropyridine, 4-methyl-5-nitropyridin-2-ol, 2-Hydroxy-5-nitro-4-picoline, zlchem 568, 4-methyl-5-nitro-1H-pyridin-2-one
| Molecular Formula | C6H6N2O3 |
|---|---|
| Molecular Weight | 154.04 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 74.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 154.03784 |
| Heavy Atoms | 11 |
| Complexity | 272.0 |
Chemical Identifiers
| CAS Number | 21901-41-7 |
|---|---|
| SMILES | CC1=CC(=O)NC=C1[N+](=O)[O-] |
| InChIKey | AIEHUZHKFUNHCJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Methyl-5-nitro-1,2-dihydropyridin-2-one (CAS 21901-41-7), with molecular formula C6H6N2O3 and molecular weight 154.04 g/mol. IUPAC: 4-methyl-5-nitro-1H-pyridin-2-one.
Chemical Property Profile of 4-Methyl-5-nitro-1,2-dihydropyridin-2-one
Property Insights of 4-Methyl-5-nitro-1,2-dihydropyridin-2-one
The XLogP value of -0.3 indicates that 4-Methyl-5-nitro-1,2-dihydropyridin-2-one is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 74.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Methyl-5-nitro-1,2-dihydropyridin-2-one. Following Lipinski's Rule of Five, 4-Methyl-5-nitro-1,2-dihydropyridin-2-one has 1 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 4-Methyl-5-nitro-1,2-dihydropyridin-2-one?
The CAS number of 4-Methyl-5-nitro-1,2-dihydropyridin-2-one is 21901-41-7.
What is the molecular formula of 4-Methyl-5-nitro-1,2-dihydropyridin-2-one?
The molecular formula of 4-Methyl-5-nitro-1,2-dihydropyridin-2-one is C6H6N2O3.
What is the molecular weight of 4-Methyl-5-nitro-1,2-dihydropyridin-2-one?
The molecular weight of 4-Methyl-5-nitro-1,2-dihydropyridin-2-one is 154.04 g/mol.
Where can I buy 4-Methyl-5-nitro-1,2-dihydropyridin-2-one?
You can request a quote for 4-Methyl-5-nitro-1,2-dihydropyridin-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methyl-5-nitro-1,2-dihydropyridin-2-one?
Yes, KEHONG BIO provides custom synthesis services for 4-Methyl-5-nitro-1,2-dihydropyridin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.