N4-Benzyl-N2-(2-fluorophenyl)-5-nitropyrimidine-2,4,6-triamine
TL;DR: N4-Benzyl-N2-(2-fluorophenyl)-5-nitropyrimidine-2,4,6-triamine (CAS 671819-16-2) is a chemical compound with molecular formula C17H15FN6O2 and molecular weight 354.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-N-benzyl-2-N-(2-fluorophenyl)-5-nitropyrimidine-2,4,6-triamine
Also Known As: N4-BENZYL-N2-(2-FLUOROPHENYL)-5-NITROPYRIMIDINE-2,4,6-TRIAMINE, 4-N-benzyl-2-N-(2-fluorophenyl)-5-nitropyrimidine-2,4,6-triamine, N'-Benzyl-N-(2-fluoro-phenyl)-5-nitro-pyrimidine-2,4,6-triamine, N4-benzyl-N2-(2-fluorophenyl)-5-nitro-pyrimidine-2,4,6-triamine, {4-amino-5-nitro-6-[benzylamino]pyrimidin-2-yl}(2-fluorophenyl)amine
| Molecular Formula | C17H15FN6O2 |
|---|---|
| Molecular Weight | 354.12 g/mol |
| LogP | 3.4618 |
| Topological Polar Surface Area | 119.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 354.12405 |
| Heavy Atoms | 26 |
| Complexity | 935.79114 |
Chemical Identifiers
| CAS Number | 671819-16-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)CNC2=NC(=NC(=C2[N+](=O)[O-])N)NC3=CC=CC=C3F |
Product Overview
N4-Benzyl-N2-(2-fluorophenyl)-5-nitropyrimidine-2,4,6-triamine (CAS 671819-16-2), with molecular formula C17H15FN6O2 and molecular weight 354.12 g/mol. IUPAC: 4-N-benzyl-2-N-(2-fluorophenyl)-5-nitropyrimidine-2,4,6-triamine.
Chemical Property Profile of N4-Benzyl-N2-(2-fluorophenyl)-5-nitropyrimidine-2,4,6-triamine
Property Insights of N4-Benzyl-N2-(2-fluorophenyl)-5-nitropyrimidine-2,4,6-triamine
The XLogP value of 3.4618 indicates that N4-Benzyl-N2-(2-fluorophenyl)-5-nitropyrimidine-2,4,6-triamine 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 N4-Benzyl-N2-(2-fluorophenyl)-5-nitropyrimidine-2,4,6-triamine. Following Lipinski's Rule of Five, N4-Benzyl-N2-(2-fluorophenyl)-5-nitropyrimidine-2,4,6-triamine 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 N4-Benzyl-N2-(2-fluorophenyl)-5-nitropyrimidine-2,4,6-triamine?
The CAS number of N4-Benzyl-N2-(2-fluorophenyl)-5-nitropyrimidine-2,4,6-triamine is 671819-16-2.
What is the molecular formula of N4-Benzyl-N2-(2-fluorophenyl)-5-nitropyrimidine-2,4,6-triamine?
The molecular formula of N4-Benzyl-N2-(2-fluorophenyl)-5-nitropyrimidine-2,4,6-triamine is C17H15FN6O2.
What is the molecular weight of N4-Benzyl-N2-(2-fluorophenyl)-5-nitropyrimidine-2,4,6-triamine?
The molecular weight of N4-Benzyl-N2-(2-fluorophenyl)-5-nitropyrimidine-2,4,6-triamine is 354.12 g/mol.
Where can I buy N4-Benzyl-N2-(2-fluorophenyl)-5-nitropyrimidine-2,4,6-triamine?
You can request a quote for N4-Benzyl-N2-(2-fluorophenyl)-5-nitropyrimidine-2,4,6-triamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N4-Benzyl-N2-(2-fluorophenyl)-5-nitropyrimidine-2,4,6-triamine?
Yes, KEHONG BIO provides custom synthesis services for N4-Benzyl-N2-(2-fluorophenyl)-5-nitropyrimidine-2,4,6-triamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.