N2,N4-dibenzyl-5-nitropyrimidine-2,4,6-triamine
TL;DR: N2,N4-dibenzyl-5-nitropyrimidine-2,4,6-triamine (CAS 29935-92-0) is a chemical compound with molecular formula C18H18N6O2 and molecular weight 350.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-N,4-N-dibenzyl-5-nitropyrimidine-2,4,6-triamine
Also Known As: ChemDiv1_002465, N2,N4-dibenzyl-5-nitropyrimidine-2,4,6-triamine, AB00550210-02, N,N'-Dibenzyl-5-nitro-pyrimidine-2,4,6-triamine, 2-N,4-N-dibenzyl-5-nitropyrimidine-2,4,6-triamine
| Molecular Formula | C18H18N6O2 |
|---|---|
| Molecular Weight | 350.15 g/mol |
| LogP | 3.1912 |
| Topological Polar Surface Area | 119.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 350.1491 |
| Heavy Atoms | 26 |
| Complexity | 886.943 |
Chemical Identifiers
| CAS Number | 29935-92-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)CNC2=NC(=NC(=C2[N+](=O)[O-])N)NCC3=CC=CC=C3 |
Product Overview
N2,N4-dibenzyl-5-nitropyrimidine-2,4,6-triamine (CAS 29935-92-0), with molecular formula C18H18N6O2 and molecular weight 350.15 g/mol. IUPAC: 2-N,4-N-dibenzyl-5-nitropyrimidine-2,4,6-triamine.
Chemical Property Profile of N2,N4-dibenzyl-5-nitropyrimidine-2,4,6-triamine
Property Insights of N2,N4-dibenzyl-5-nitropyrimidine-2,4,6-triamine
The XLogP value of 3.1912 indicates that N2,N4-dibenzyl-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 N2,N4-dibenzyl-5-nitropyrimidine-2,4,6-triamine. Following Lipinski's Rule of Five, N2,N4-dibenzyl-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 N2,N4-dibenzyl-5-nitropyrimidine-2,4,6-triamine?
The CAS number of N2,N4-dibenzyl-5-nitropyrimidine-2,4,6-triamine is 29935-92-0.
What is the molecular formula of N2,N4-dibenzyl-5-nitropyrimidine-2,4,6-triamine?
The molecular formula of N2,N4-dibenzyl-5-nitropyrimidine-2,4,6-triamine is C18H18N6O2.
What is the molecular weight of N2,N4-dibenzyl-5-nitropyrimidine-2,4,6-triamine?
The molecular weight of N2,N4-dibenzyl-5-nitropyrimidine-2,4,6-triamine is 350.15 g/mol.
Where can I buy N2,N4-dibenzyl-5-nitropyrimidine-2,4,6-triamine?
You can request a quote for N2,N4-dibenzyl-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 N2,N4-dibenzyl-5-nitropyrimidine-2,4,6-triamine?
Yes, KEHONG BIO provides custom synthesis services for N2,N4-dibenzyl-5-nitropyrimidine-2,4,6-triamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.