N-methyl-N-(3-nitropyridin-4-yl)nitramide
TL;DR: N-methyl-N-(3-nitropyridin-4-yl)nitramide (CAS 104503-82-4) is a chemical compound with molecular formula C6H6N4O4 and molecular weight 198.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-methyl-N-(3-nitro-4-pyridinyl)nitramide
Also Known As: N-methyl-N-(3-nitropyridin-4-yl)nitramide, 4-Pyridinamine, N-methyl-N,3-dinitro-, 4-Pyridinamine,N-methyl-N,3-dinitro-(9CI), 4-Pyridinamine, N-methyl-N,3-dinitro- (9CI), 4-(1-Methyl-2-oxido-2-oxohydrazino)-3-nitropyridine #
| Molecular Formula | C6H6N4O4 |
|---|---|
| Molecular Weight | 198.04 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 108.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 198.03891 |
| Heavy Atoms | 14 |
| Complexity | 235.0 |
Chemical Identifiers
| CAS Number | 104503-82-4 |
|---|---|
| SMILES | CN(C1=C(C=NC=C1)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | ITGRUAVJCYFZPV-UHFFFAOYSA-N |
Product Overview
N-methyl-N-(3-nitropyridin-4-yl)nitramide (CAS 104503-82-4), with molecular formula C6H6N4O4 and molecular weight 198.04 g/mol. IUPAC: N-methyl-N-(3-nitro-4-pyridinyl)nitramide.
Chemical Property Profile of N-methyl-N-(3-nitropyridin-4-yl)nitramide
Property Insights of N-methyl-N-(3-nitropyridin-4-yl)nitramide
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-methyl-N-(3-nitropyridin-4-yl)nitramide. The TPSA of 108.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-methyl-N-(3-nitropyridin-4-yl)nitramide. Following Lipinski's Rule of Five, N-methyl-N-(3-nitropyridin-4-yl)nitramide has 0 hydrogen bond donor(s) and 6 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 N-methyl-N-(3-nitropyridin-4-yl)nitramide?
The CAS number of N-methyl-N-(3-nitropyridin-4-yl)nitramide is 104503-82-4.
What is the molecular formula of N-methyl-N-(3-nitropyridin-4-yl)nitramide?
The molecular formula of N-methyl-N-(3-nitropyridin-4-yl)nitramide is C6H6N4O4.
What is the molecular weight of N-methyl-N-(3-nitropyridin-4-yl)nitramide?
The molecular weight of N-methyl-N-(3-nitropyridin-4-yl)nitramide is 198.04 g/mol.
Where can I buy N-methyl-N-(3-nitropyridin-4-yl)nitramide?
You can request a quote for N-methyl-N-(3-nitropyridin-4-yl)nitramide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-methyl-N-(3-nitropyridin-4-yl)nitramide?
Yes, KEHONG BIO provides custom synthesis services for N-methyl-N-(3-nitropyridin-4-yl)nitramide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.