![{6-Amino-2-[(3-methylbutyl)amino]-5-nitropyrimidin-4-yl}(4-methylphenyl)amine structure](/static/products/672/672920-73-9.png)
{6-Amino-2-[(3-methylbutyl)amino]-5-nitropyrimidin-4-yl}(4-methylphenyl)amine
TL;DR: {6-Amino-2-[(3-methylbutyl)amino]-5-nitropyrimidin-4-yl}(4-methylphenyl)amine (CAS 672920-73-9) is a chemical compound with molecular formula C16H22N6O2 and molecular weight 330.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-N-(3-methylbutyl)-4-N-(4-methylphenyl)-5-nitropyrimidine-2,4,6-triamine
Also Known As: N2-isopentyl-5-nitro-N4-(p-tolyl)pyrimidine-2,4,6-triamine, N2-(3-methylbutyl)-N4-(4-methylphenyl)-5-nitropyrimidine-2,4,6-triamine, {6-amino-2-[(3-methylbutyl)amino]-5-nitropyrimidin-4-yl}(4-methylphenyl)amine, 2-N-(3-methylbutyl)-4-N-(4-methylphenyl)-5-nitropyrimidine-2,4,6-triamine, N~2~-(3-methylbutyl)-N~4~-(4-methylphenyl)-5-nitropyrimidine-2,4,6-triamine
| Molecular Formula | C16H22N6O2 |
|---|---|
| Molecular Weight | 330.18 g/mol |
| LogP | 3.47702 |
| Topological Polar Surface Area | 119.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 330.18042 |
| Heavy Atoms | 24 |
| Complexity | 715.25275 |
Chemical Identifiers
| CAS Number | 672920-73-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC2=NC(=NC(=C2[N+](=O)[O-])N)NCCC(C)C |
Product Overview
{6-Amino-2-[(3-methylbutyl)amino]-5-nitropyrimidin-4-yl}(4-methylphenyl)amine (CAS 672920-73-9), with molecular formula C16H22N6O2 and molecular weight 330.18 g/mol. IUPAC: 2-N-(3-methylbutyl)-4-N-(4-methylphenyl)-5-nitropyrimidine-2,4,6-triamine.
Chemical Property Profile of {6-Amino-2-[(3-methylbutyl)amino]-5-nitropyrimidin-4-yl}(4-methylphenyl)amine
Property Insights of {6-Amino-2-[(3-methylbutyl)amino]-5-nitropyrimidin-4-yl}(4-methylphenyl)amine
The XLogP value of 3.47702 indicates that {6-Amino-2-[(3-methylbutyl)amino]-5-nitropyrimidin-4-yl}(4-methylphenyl)amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 119.0 Ų falls within the moderate polarity range, balancing permeability and solubility for {6-Amino-2-[(3-methylbutyl)amino]-5-nitropyrimidin-4-yl}(4-methylphenyl)amine. Following Lipinski's Rule of Five, {6-Amino-2-[(3-methylbutyl)amino]-5-nitropyrimidin-4-yl}(4-methylphenyl)amine has 3 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 {6-Amino-2-[(3-methylbutyl)amino]-5-nitropyrimidin-4-yl}(4-methylphenyl)amine?
The CAS number of {6-Amino-2-[(3-methylbutyl)amino]-5-nitropyrimidin-4-yl}(4-methylphenyl)amine is 672920-73-9.
What is the molecular formula of {6-Amino-2-[(3-methylbutyl)amino]-5-nitropyrimidin-4-yl}(4-methylphenyl)amine?
The molecular formula of {6-Amino-2-[(3-methylbutyl)amino]-5-nitropyrimidin-4-yl}(4-methylphenyl)amine is C16H22N6O2.
What is the molecular weight of {6-Amino-2-[(3-methylbutyl)amino]-5-nitropyrimidin-4-yl}(4-methylphenyl)amine?
The molecular weight of {6-Amino-2-[(3-methylbutyl)amino]-5-nitropyrimidin-4-yl}(4-methylphenyl)amine is 330.18 g/mol.
Where can I buy {6-Amino-2-[(3-methylbutyl)amino]-5-nitropyrimidin-4-yl}(4-methylphenyl)amine?
You can request a quote for {6-Amino-2-[(3-methylbutyl)amino]-5-nitropyrimidin-4-yl}(4-methylphenyl)amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for {6-Amino-2-[(3-methylbutyl)amino]-5-nitropyrimidin-4-yl}(4-methylphenyl)amine?
Yes, KEHONG BIO provides custom synthesis services for {6-Amino-2-[(3-methylbutyl)amino]-5-nitropyrimidin-4-yl}(4-methylphenyl)amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.