![{6-Amino-5-nitro-2-[4-benzylpiperidyl]pyrimidin-4-yl}benzylamine structure](/static/products/836/836631-82-4.png)
{6-Amino-5-nitro-2-[4-benzylpiperidyl]pyrimidin-4-yl}benzylamine
TL;DR: {6-Amino-5-nitro-2-[4-benzylpiperidyl]pyrimidin-4-yl}benzylamine (CAS 836631-82-4) is a chemical compound with molecular formula C23H26N6O2 and molecular weight 418.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-N-benzyl-2-(4-benzylpiperidin-1-yl)-5-nitropyrimidine-4,6-diamine
Also Known As: {6-amino-5-nitro-2-[4-benzylpiperidyl]pyrimidin-4-yl}benzylamine, N-benzyl-2-(4-benzylpiperidin-1-yl)-5-nitropyrimidine-4,6-diamine, 4-N-benzyl-2-(4-benzylpiperidin-1-yl)-5-nitropyrimidine-4,6-diamine, N4-BENZYL-2-(4-BENZYLPIPERIDIN-1-YL)-5-NITROPYRIMIDINE-4,6-DIAMINE
| Molecular Formula | C23H26N6O2 |
|---|---|
| Molecular Weight | 418.21 g/mol |
| LogP | 4.0382 |
| Topological Polar Surface Area | 110.21 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 418.21173 |
| Heavy Atoms | 31 |
| Complexity | 1020.9965 |
Chemical Identifiers
| CAS Number | 836631-82-4 |
|---|---|
| SMILES | C1CN(CCC1CC2=CC=CC=C2)C3=NC(=C(C(=N3)NCC4=CC=CC=C4)[N+](=O)[O-])N |
Product Overview
{6-Amino-5-nitro-2-[4-benzylpiperidyl]pyrimidin-4-yl}benzylamine (CAS 836631-82-4), with molecular formula C23H26N6O2 and molecular weight 418.21 g/mol. IUPAC: 4-N-benzyl-2-(4-benzylpiperidin-1-yl)-5-nitropyrimidine-4,6-diamine.
Chemical Property Profile of {6-Amino-5-nitro-2-[4-benzylpiperidyl]pyrimidin-4-yl}benzylamine
Property Insights of {6-Amino-5-nitro-2-[4-benzylpiperidyl]pyrimidin-4-yl}benzylamine
The XLogP value of 4.0382 indicates that {6-Amino-5-nitro-2-[4-benzylpiperidyl]pyrimidin-4-yl}benzylamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 110.21 Ų falls within the moderate polarity range, balancing permeability and solubility for {6-Amino-5-nitro-2-[4-benzylpiperidyl]pyrimidin-4-yl}benzylamine. Following Lipinski's Rule of Five, {6-Amino-5-nitro-2-[4-benzylpiperidyl]pyrimidin-4-yl}benzylamine 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 {6-Amino-5-nitro-2-[4-benzylpiperidyl]pyrimidin-4-yl}benzylamine?
The CAS number of {6-Amino-5-nitro-2-[4-benzylpiperidyl]pyrimidin-4-yl}benzylamine is 836631-82-4.
What is the molecular formula of {6-Amino-5-nitro-2-[4-benzylpiperidyl]pyrimidin-4-yl}benzylamine?
The molecular formula of {6-Amino-5-nitro-2-[4-benzylpiperidyl]pyrimidin-4-yl}benzylamine is C23H26N6O2.
What is the molecular weight of {6-Amino-5-nitro-2-[4-benzylpiperidyl]pyrimidin-4-yl}benzylamine?
The molecular weight of {6-Amino-5-nitro-2-[4-benzylpiperidyl]pyrimidin-4-yl}benzylamine is 418.21 g/mol.
Where can I buy {6-Amino-5-nitro-2-[4-benzylpiperidyl]pyrimidin-4-yl}benzylamine?
You can request a quote for {6-Amino-5-nitro-2-[4-benzylpiperidyl]pyrimidin-4-yl}benzylamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for {6-Amino-5-nitro-2-[4-benzylpiperidyl]pyrimidin-4-yl}benzylamine?
Yes, KEHONG BIO provides custom synthesis services for {6-Amino-5-nitro-2-[4-benzylpiperidyl]pyrimidin-4-yl}benzylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.