![{4-Amino-6-[(4-methylphenyl)amino]-5-nitropyrimidin-2-yl}methylphenylamine structure](/static/products/840/840461-82-7.png)
{4-Amino-6-[(4-methylphenyl)amino]-5-nitropyrimidin-2-yl}methylphenylamine
TL;DR: {4-Amino-6-[(4-methylphenyl)amino]-5-nitropyrimidin-2-yl}methylphenylamine (CAS 840461-82-7) is a chemical compound with molecular formula C18H18N6O2 and molecular weight 350.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-N-methyl-4-N-(4-methylphenyl)-5-nitro-2-N-phenylpyrimidine-2,4,6-triamine
Also Known As: N2-methyl-5-nitro-N2-phenyl-N4-(p-tolyl)pyrimidine-2,4,6-triamine, {4-amino-6-[(4-methylphenyl)amino]-5-nitropyrimidin-2-yl}methylphenylamine, 2-N-methyl-4-N-(4-methylphenyl)-5-nitro-2-N-phenylpyrimidine-2,4,6-triamine, N~2~-methyl-N~4~-(4-methylphenyl)-5-nitro-N~2~-phenylpyrimidine-2,4,6-triamine
| Molecular Formula | C18H18N6O2 |
|---|---|
| Molecular Weight | 350.15 g/mol |
| LogP | 3.78692 |
| Topological Polar Surface Area | 110.21 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 350.1491 |
| Heavy Atoms | 26 |
| Complexity | 928.41626 |
Chemical Identifiers
| CAS Number | 840461-82-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC2=NC(=NC(=C2[N+](=O)[O-])N)N(C)C3=CC=CC=C3 |
Product Overview
{4-Amino-6-[(4-methylphenyl)amino]-5-nitropyrimidin-2-yl}methylphenylamine (CAS 840461-82-7), with molecular formula C18H18N6O2 and molecular weight 350.15 g/mol. IUPAC: 2-N-methyl-4-N-(4-methylphenyl)-5-nitro-2-N-phenylpyrimidine-2,4,6-triamine.
Chemical Property Profile of {4-Amino-6-[(4-methylphenyl)amino]-5-nitropyrimidin-2-yl}methylphenylamine
Property Insights of {4-Amino-6-[(4-methylphenyl)amino]-5-nitropyrimidin-2-yl}methylphenylamine
The XLogP value of 3.78692 indicates that {4-Amino-6-[(4-methylphenyl)amino]-5-nitropyrimidin-2-yl}methylphenylamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 110.21 Ų falls within the moderate polarity range, balancing permeability and solubility for {4-Amino-6-[(4-methylphenyl)amino]-5-nitropyrimidin-2-yl}methylphenylamine. Following Lipinski's Rule of Five, {4-Amino-6-[(4-methylphenyl)amino]-5-nitropyrimidin-2-yl}methylphenylamine has 2 hydrogen bond donor(s) and 7 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-Amino-6-[(4-methylphenyl)amino]-5-nitropyrimidin-2-yl}methylphenylamine?
The CAS number of {4-Amino-6-[(4-methylphenyl)amino]-5-nitropyrimidin-2-yl}methylphenylamine is 840461-82-7.
What is the molecular formula of {4-Amino-6-[(4-methylphenyl)amino]-5-nitropyrimidin-2-yl}methylphenylamine?
The molecular formula of {4-Amino-6-[(4-methylphenyl)amino]-5-nitropyrimidin-2-yl}methylphenylamine is C18H18N6O2.
What is the molecular weight of {4-Amino-6-[(4-methylphenyl)amino]-5-nitropyrimidin-2-yl}methylphenylamine?
The molecular weight of {4-Amino-6-[(4-methylphenyl)amino]-5-nitropyrimidin-2-yl}methylphenylamine is 350.15 g/mol.
Where can I buy {4-Amino-6-[(4-methylphenyl)amino]-5-nitropyrimidin-2-yl}methylphenylamine?
You can request a quote for {4-Amino-6-[(4-methylphenyl)amino]-5-nitropyrimidin-2-yl}methylphenylamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for {4-Amino-6-[(4-methylphenyl)amino]-5-nitropyrimidin-2-yl}methylphenylamine?
Yes, KEHONG BIO provides custom synthesis services for {4-Amino-6-[(4-methylphenyl)amino]-5-nitropyrimidin-2-yl}methylphenylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.