2-N-(4-methoxyphenyl)-6-(4-methylpiperazin-1-yl)-5-nitropyrimidine-2,4-diamine
TL;DR: 2-N-(4-methoxyphenyl)-6-(4-methylpiperazin-1-yl)-5-nitropyrimidine-2,4-diamine (CAS 714247-39-9) is a chemical compound with molecular formula C16H21N7O3 and molecular weight 359.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-N-(4-methoxyphenyl)-6-(4-methylpiperazin-1-yl)-5-nitropyrimidine-2,4-diamine
Also Known As: 2-N-(4-methoxyphenyl)-6-(4-methylpiperazin-1-yl)-5-nitropyrimidine-2,4-diamine, N-(4-methoxyphenyl)-6-(4-methylpiperazin-1-yl)-5-nitro-pyrimidine-2,4-diamine, N2-(4-METHOXYPHENYL)-6-(4-METHYLPIPERAZIN-1-YL)-5-NITROPYRIMIDINE-2,4-DIAMINE, (2E)-2-[(4-methoxyphenyl)imino]-6-(4-methylpiperazin-1-yl)-5-nitro-1,2-dihydropyrimidin-4-amine
| Molecular Formula | C16H21N7O3 |
|---|---|
| Molecular Weight | 359.17 g/mol |
| LogP | 1.471 |
| Topological Polar Surface Area | 122.68 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 5 |
| Exact Mass | 359.1706 |
| Heavy Atoms | 26 |
| Complexity | 789.17554 |
Chemical Identifiers
| CAS Number | 714247-39-9 |
|---|---|
| SMILES | CN1CCN(CC1)C2=NC(=NC(=C2[N+](=O)[O-])N)NC3=CC=C(C=C3)OC |
Product Overview
2-N-(4-methoxyphenyl)-6-(4-methylpiperazin-1-yl)-5-nitropyrimidine-2,4-diamine (CAS 714247-39-9), with molecular formula C16H21N7O3 and molecular weight 359.17 g/mol. IUPAC: 2-N-(4-methoxyphenyl)-6-(4-methylpiperazin-1-yl)-5-nitropyrimidine-2,4-diamine.
Chemical Property Profile of 2-N-(4-methoxyphenyl)-6-(4-methylpiperazin-1-yl)-5-nitropyrimidine-2,4-diamine
Property Insights of 2-N-(4-methoxyphenyl)-6-(4-methylpiperazin-1-yl)-5-nitropyrimidine-2,4-diamine
The XLogP value of 1.471 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-N-(4-methoxyphenyl)-6-(4-methylpiperazin-1-yl)-5-nitropyrimidine-2,4-diamine. The TPSA of 122.68 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-N-(4-methoxyphenyl)-6-(4-methylpiperazin-1-yl)-5-nitropyrimidine-2,4-diamine. Following Lipinski's Rule of Five, 2-N-(4-methoxyphenyl)-6-(4-methylpiperazin-1-yl)-5-nitropyrimidine-2,4-diamine has 2 hydrogen bond donor(s) and 9 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 2-N-(4-methoxyphenyl)-6-(4-methylpiperazin-1-yl)-5-nitropyrimidine-2,4-diamine?
The CAS number of 2-N-(4-methoxyphenyl)-6-(4-methylpiperazin-1-yl)-5-nitropyrimidine-2,4-diamine is 714247-39-9.
What is the molecular formula of 2-N-(4-methoxyphenyl)-6-(4-methylpiperazin-1-yl)-5-nitropyrimidine-2,4-diamine?
The molecular formula of 2-N-(4-methoxyphenyl)-6-(4-methylpiperazin-1-yl)-5-nitropyrimidine-2,4-diamine is C16H21N7O3.
What is the molecular weight of 2-N-(4-methoxyphenyl)-6-(4-methylpiperazin-1-yl)-5-nitropyrimidine-2,4-diamine?
The molecular weight of 2-N-(4-methoxyphenyl)-6-(4-methylpiperazin-1-yl)-5-nitropyrimidine-2,4-diamine is 359.17 g/mol.
Where can I buy 2-N-(4-methoxyphenyl)-6-(4-methylpiperazin-1-yl)-5-nitropyrimidine-2,4-diamine?
You can request a quote for 2-N-(4-methoxyphenyl)-6-(4-methylpiperazin-1-yl)-5-nitropyrimidine-2,4-diamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-N-(4-methoxyphenyl)-6-(4-methylpiperazin-1-yl)-5-nitropyrimidine-2,4-diamine?
Yes, KEHONG BIO provides custom synthesis services for 2-N-(4-methoxyphenyl)-6-(4-methylpiperazin-1-yl)-5-nitropyrimidine-2,4-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.