1-Methyl-3,5-dinitro-1H-pyridin-2-one
TL;DR: 1-Methyl-3,5-dinitro-1H-pyridin-2-one (CAS 14150-94-8) is a chemical compound with molecular formula C6H5N3O5 and molecular weight 199.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-3,5-dinitropyridin-2-one
Also Known As: 1-METHYL-3,5-DINITRO-1H-PYRIDIN-2-ONE, 1-Methyl-3,5-dinitropyridin-2(1H)-one, 1-methyl-3,5-dinitropyridin-2-one, 1-methyl-3,5-dinitro-1,2-dihydropyridin-2-one, 2(1H)-Pyridinone, 1-methyl-3,5-dinitro-
| Molecular Formula | C6H5N3O5 |
|---|---|
| Molecular Weight | 199.02 g/mol |
| LogP | 0.2017 |
| Topological Polar Surface Area | 108.28 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 199.02292 |
| Heavy Atoms | 14 |
| Complexity | 463.02505 |
Chemical Identifiers
| CAS Number | 14150-94-8 |
|---|---|
| SMILES | CN1C=C(C=C(C1=O)[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
1-Methyl-3,5-dinitro-1H-pyridin-2-one (CAS 14150-94-8), with molecular formula C6H5N3O5 and molecular weight 199.02 g/mol. IUPAC: 1-methyl-3,5-dinitropyridin-2-one.
Chemical Property Profile of 1-Methyl-3,5-dinitro-1H-pyridin-2-one
Property Insights of 1-Methyl-3,5-dinitro-1H-pyridin-2-one
The XLogP value of 0.2017 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Methyl-3,5-dinitro-1H-pyridin-2-one. The TPSA of 108.28 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Methyl-3,5-dinitro-1H-pyridin-2-one. Following Lipinski's Rule of Five, 1-Methyl-3,5-dinitro-1H-pyridin-2-one has 0 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 1-Methyl-3,5-dinitro-1H-pyridin-2-one?
The CAS number of 1-Methyl-3,5-dinitro-1H-pyridin-2-one is 14150-94-8.
What is the molecular formula of 1-Methyl-3,5-dinitro-1H-pyridin-2-one?
The molecular formula of 1-Methyl-3,5-dinitro-1H-pyridin-2-one is C6H5N3O5.
What is the molecular weight of 1-Methyl-3,5-dinitro-1H-pyridin-2-one?
The molecular weight of 1-Methyl-3,5-dinitro-1H-pyridin-2-one is 199.02 g/mol.
Where can I buy 1-Methyl-3,5-dinitro-1H-pyridin-2-one?
You can request a quote for 1-Methyl-3,5-dinitro-1H-pyridin-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methyl-3,5-dinitro-1H-pyridin-2-one?
Yes, KEHONG BIO provides custom synthesis services for 1-Methyl-3,5-dinitro-1H-pyridin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.