N-(3,4-dimethylphenyl)-2-(4-methylpiperazin-1-yl)-5-nitropyrimidine-4,6-diamine
TL;DR: N-(3,4-dimethylphenyl)-2-(4-methylpiperazin-1-yl)-5-nitropyrimidine-4,6-diamine (CAS 573938-48-4) is a chemical compound with molecular formula C17H23N7O2 and molecular weight 357.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-N-(3,4-dimethylphenyl)-2-(4-methylpiperazin-1-yl)-5-nitropyrimidine-4,6-diamine
Also Known As: N4-(3,4-DIMETHYLPHENYL)-2-(4-METHYLPIPERAZIN-1-YL)-5-NITROPYRIMIDINE-4,6-DIAMINE, [6-amino-2-(4-methylpiperazinyl)-5-nitropyrimidin-4-yl](3,4-dimethylphenyl)ami ne, 4-N-(3,4-dimethylphenyl)-2-(4-methylpiperazin-1-yl)-5-nitropyrimidine-4,6-diamine, N-(3,4-Dimethyl-phenyl)-2-(4-methyl-piperazin-1-yl)-5-nitro-pyrimidine-4,6-diamine, N-(3,4-dimethylphenyl)-2-(4-methylpiperazin-1-yl)-5-nitropyrimidine-4,6-diamine
| Molecular Formula | C17H23N7O2 |
|---|---|
| Molecular Weight | 357.19 g/mol |
| LogP | 2.07924 |
| Topological Polar Surface Area | 113.45 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 357.1913 |
| Heavy Atoms | 26 |
| Complexity | 832.1014 |
Chemical Identifiers
| CAS Number | 573938-48-4 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)NC2=NC(=NC(=C2[N+](=O)[O-])N)N3CCN(CC3)C)C |
Product Overview
N-(3,4-dimethylphenyl)-2-(4-methylpiperazin-1-yl)-5-nitropyrimidine-4,6-diamine (CAS 573938-48-4), with molecular formula C17H23N7O2 and molecular weight 357.19 g/mol. IUPAC: 4-N-(3,4-dimethylphenyl)-2-(4-methylpiperazin-1-yl)-5-nitropyrimidine-4,6-diamine.
Chemical Property Profile of N-(3,4-dimethylphenyl)-2-(4-methylpiperazin-1-yl)-5-nitropyrimidine-4,6-diamine
Property Insights of N-(3,4-dimethylphenyl)-2-(4-methylpiperazin-1-yl)-5-nitropyrimidine-4,6-diamine
The XLogP value of 2.07924 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3,4-dimethylphenyl)-2-(4-methylpiperazin-1-yl)-5-nitropyrimidine-4,6-diamine. The TPSA of 113.45 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3,4-dimethylphenyl)-2-(4-methylpiperazin-1-yl)-5-nitropyrimidine-4,6-diamine. Following Lipinski's Rule of Five, N-(3,4-dimethylphenyl)-2-(4-methylpiperazin-1-yl)-5-nitropyrimidine-4,6-diamine has 2 hydrogen bond donor(s) and 8 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 N-(3,4-dimethylphenyl)-2-(4-methylpiperazin-1-yl)-5-nitropyrimidine-4,6-diamine?
The CAS number of N-(3,4-dimethylphenyl)-2-(4-methylpiperazin-1-yl)-5-nitropyrimidine-4,6-diamine is 573938-48-4.
What is the molecular formula of N-(3,4-dimethylphenyl)-2-(4-methylpiperazin-1-yl)-5-nitropyrimidine-4,6-diamine?
The molecular formula of N-(3,4-dimethylphenyl)-2-(4-methylpiperazin-1-yl)-5-nitropyrimidine-4,6-diamine is C17H23N7O2.
What is the molecular weight of N-(3,4-dimethylphenyl)-2-(4-methylpiperazin-1-yl)-5-nitropyrimidine-4,6-diamine?
The molecular weight of N-(3,4-dimethylphenyl)-2-(4-methylpiperazin-1-yl)-5-nitropyrimidine-4,6-diamine is 357.19 g/mol.
Where can I buy N-(3,4-dimethylphenyl)-2-(4-methylpiperazin-1-yl)-5-nitropyrimidine-4,6-diamine?
You can request a quote for N-(3,4-dimethylphenyl)-2-(4-methylpiperazin-1-yl)-5-nitropyrimidine-4,6-diamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3,4-dimethylphenyl)-2-(4-methylpiperazin-1-yl)-5-nitropyrimidine-4,6-diamine?
Yes, KEHONG BIO provides custom synthesis services for N-(3,4-dimethylphenyl)-2-(4-methylpiperazin-1-yl)-5-nitropyrimidine-4,6-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.