1-Methyl-3-nitro-1H-pyrazol-4-amine
TL;DR: 1-Methyl-3-nitro-1H-pyrazol-4-amine (CAS 39205-76-0) is a chemical compound with molecular formula C4H6N4O2 and molecular weight 142.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-3-nitropyrazol-4-amine
Also Known As: 1-Methyl-3-nitro-1H-pyrazol-4-amine, amino-1-methylnitropyrazole, 1-methyl-3-nitropyrazol-4-amine, WSPATACRXQZVGG-UHFFFAOYSA-, 4-Amino-1-methyl-3-nitropyrazole
| Molecular Formula | C4H6N4O2 |
|---|---|
| Molecular Weight | 142.05 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 89.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 142.04907 |
| Heavy Atoms | 10 |
| Complexity | 145.0 |
Chemical Identifiers
| CAS Number | 39205-76-0 |
|---|---|
| SMILES | CN1C=C(C(=N1)[N+](=O)[O-])N |
| InChIKey | WSPATACRXQZVGG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Methyl-3-nitro-1H-pyrazol-4-amine (CAS 39205-76-0), with molecular formula C4H6N4O2 and molecular weight 142.05 g/mol. IUPAC: 1-methyl-3-nitropyrazol-4-amine.
Chemical Property Profile of 1-Methyl-3-nitro-1H-pyrazol-4-amine
Property Insights of 1-Methyl-3-nitro-1H-pyrazol-4-amine
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Methyl-3-nitro-1H-pyrazol-4-amine. The TPSA of 89.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Methyl-3-nitro-1H-pyrazol-4-amine. Following Lipinski's Rule of Five, 1-Methyl-3-nitro-1H-pyrazol-4-amine has 1 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 1-Methyl-3-nitro-1H-pyrazol-4-amine?
The CAS number of 1-Methyl-3-nitro-1H-pyrazol-4-amine is 39205-76-0.
What is the molecular formula of 1-Methyl-3-nitro-1H-pyrazol-4-amine?
The molecular formula of 1-Methyl-3-nitro-1H-pyrazol-4-amine is C4H6N4O2.
What is the molecular weight of 1-Methyl-3-nitro-1H-pyrazol-4-amine?
The molecular weight of 1-Methyl-3-nitro-1H-pyrazol-4-amine is 142.05 g/mol.
Where can I buy 1-Methyl-3-nitro-1H-pyrazol-4-amine?
You can request a quote for 1-Methyl-3-nitro-1H-pyrazol-4-amine 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-nitro-1H-pyrazol-4-amine?
Yes, KEHONG BIO provides custom synthesis services for 1-Methyl-3-nitro-1H-pyrazol-4-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.