![{4-Amino-6-[(4-chlorophenyl)amino]-5-nitropyrimidin-2-yl}dimethylamine structure](/static/products/840/840457-72-9.png)
{4-Amino-6-[(4-chlorophenyl)amino]-5-nitropyrimidin-2-yl}dimethylamine
TL;DR: {4-Amino-6-[(4-chlorophenyl)amino]-5-nitropyrimidin-2-yl}dimethylamine (CAS 840457-72-9) is a chemical compound with molecular formula C12H13ClN6O2 and molecular weight 308.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-N-(4-chlorophenyl)-2-N,2-N-dimethyl-5-nitropyrimidine-2,4,6-triamine
Also Known As: {4-amino-6-[(4-chlorophenyl)amino]-5-nitropyrimidin-2-yl}dimethylamine, 4-N-(4-chlorophenyl)-2-N,2-N-dimethyl-5-nitropyrimidine-2,4,6-triamine, N4-(4-chlorophenyl)-N2,N2-dimethyl-5-nitropyrimidine-2,4,6-triamine, N~4~-(4-chlorophenyl)-N~2~,N~2~-dimethyl-5-nitropyrimidine-2,4,6-triamine
| Molecular Formula | C12H13ClN6O2 |
|---|---|
| Molecular Weight | 308.08 g/mol |
| LogP | 2.43 |
| Topological Polar Surface Area | 110.21 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 308.07886 |
| Heavy Atoms | 21 |
| Complexity | 674.193 |
Chemical Identifiers
| CAS Number | 840457-72-9 |
|---|---|
| SMILES | CN(C)C1=NC(=C(C(=N1)NC2=CC=C(C=C2)Cl)[N+](=O)[O-])N |
Product Overview
{4-Amino-6-[(4-chlorophenyl)amino]-5-nitropyrimidin-2-yl}dimethylamine (CAS 840457-72-9), with molecular formula C12H13ClN6O2 and molecular weight 308.08 g/mol. IUPAC: 4-N-(4-chlorophenyl)-2-N,2-N-dimethyl-5-nitropyrimidine-2,4,6-triamine.
Chemical Property Profile of {4-Amino-6-[(4-chlorophenyl)amino]-5-nitropyrimidin-2-yl}dimethylamine
Property Insights of {4-Amino-6-[(4-chlorophenyl)amino]-5-nitropyrimidin-2-yl}dimethylamine
The XLogP value of 2.43 suggests moderate lipophilicity, balancing water solubility and membrane permeability for {4-Amino-6-[(4-chlorophenyl)amino]-5-nitropyrimidin-2-yl}dimethylamine. The TPSA of 110.21 Ų falls within the moderate polarity range, balancing permeability and solubility for {4-Amino-6-[(4-chlorophenyl)amino]-5-nitropyrimidin-2-yl}dimethylamine. Following Lipinski's Rule of Five, {4-Amino-6-[(4-chlorophenyl)amino]-5-nitropyrimidin-2-yl}dimethylamine 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-chlorophenyl)amino]-5-nitropyrimidin-2-yl}dimethylamine?
The CAS number of {4-Amino-6-[(4-chlorophenyl)amino]-5-nitropyrimidin-2-yl}dimethylamine is 840457-72-9.
What is the molecular formula of {4-Amino-6-[(4-chlorophenyl)amino]-5-nitropyrimidin-2-yl}dimethylamine?
The molecular formula of {4-Amino-6-[(4-chlorophenyl)amino]-5-nitropyrimidin-2-yl}dimethylamine is C12H13ClN6O2.
What is the molecular weight of {4-Amino-6-[(4-chlorophenyl)amino]-5-nitropyrimidin-2-yl}dimethylamine?
The molecular weight of {4-Amino-6-[(4-chlorophenyl)amino]-5-nitropyrimidin-2-yl}dimethylamine is 308.08 g/mol.
Where can I buy {4-Amino-6-[(4-chlorophenyl)amino]-5-nitropyrimidin-2-yl}dimethylamine?
You can request a quote for {4-Amino-6-[(4-chlorophenyl)amino]-5-nitropyrimidin-2-yl}dimethylamine 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-chlorophenyl)amino]-5-nitropyrimidin-2-yl}dimethylamine?
Yes, KEHONG BIO provides custom synthesis services for {4-Amino-6-[(4-chlorophenyl)amino]-5-nitropyrimidin-2-yl}dimethylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.