![{6-Amino-5-nitro-2-[4-benzylpiperidyl]pyrimidin-4-yl}(oxolan-2-ylmethyl)amine structure](/static/products/573/573930-70-8.png)
{6-Amino-5-nitro-2-[4-benzylpiperidyl]pyrimidin-4-yl}(oxolan-2-ylmethyl)amine
TL;DR: {6-Amino-5-nitro-2-[4-benzylpiperidyl]pyrimidin-4-yl}(oxolan-2-ylmethyl)amine (CAS 573930-70-8) is a chemical compound with molecular formula C21H28N6O3 and molecular weight 412.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-benzylpiperidin-1-yl)-5-nitro-4-N-(oxolan-2-ylmethyl)pyrimidine-4,6-diamine
Also Known As: {6-amino-5-nitro-2-[4-benzylpiperidyl]pyrimidin-4-yl}(oxolan-2-ylmethyl)amine, 2-(4-benzyl-1-piperidyl)-5-nitro-N-(oxolan-2-ylmethyl)pyrimidine-4,6-diamine, 2-(4-benzylpiperidin-1-yl)-5-nitro-4-N-(oxolan-2-ylmethyl)pyrimidine-4,6-diamine, 2-(4-benzylpiperidin-1-yl)-5-nitro-N-(tetrahydrofuran-2-ylmethyl)pyrimidine-4,6-diamine, 2-(4-benzylpiperidin-1-yl)-5-nitro-N4-((tetrahydrofuran-2-yl)methyl)pyrimidine-4,6-diamine
| Molecular Formula | C21H28N6O3 |
|---|---|
| Molecular Weight | 412.22 g/mol |
| LogP | 3.017 |
| Topological Polar Surface Area | 119.44 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 412.2223 |
| Heavy Atoms | 30 |
| Complexity | 864.5455 |
Chemical Identifiers
| CAS Number | 573930-70-8 |
|---|---|
| SMILES | C1CC(OC1)CNC2=NC(=NC(=C2[N+](=O)[O-])N)N3CCC(CC3)CC4=CC=CC=C4 |
Product Overview
{6-Amino-5-nitro-2-[4-benzylpiperidyl]pyrimidin-4-yl}(oxolan-2-ylmethyl)amine (CAS 573930-70-8), with molecular formula C21H28N6O3 and molecular weight 412.22 g/mol. IUPAC: 2-(4-benzylpiperidin-1-yl)-5-nitro-4-N-(oxolan-2-ylmethyl)pyrimidine-4,6-diamine.
Chemical Property Profile of {6-Amino-5-nitro-2-[4-benzylpiperidyl]pyrimidin-4-yl}(oxolan-2-ylmethyl)amine
Property Insights of {6-Amino-5-nitro-2-[4-benzylpiperidyl]pyrimidin-4-yl}(oxolan-2-ylmethyl)amine
The XLogP value of 3.017 indicates that {6-Amino-5-nitro-2-[4-benzylpiperidyl]pyrimidin-4-yl}(oxolan-2-ylmethyl)amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 119.44 Ų falls within the moderate polarity range, balancing permeability and solubility for {6-Amino-5-nitro-2-[4-benzylpiperidyl]pyrimidin-4-yl}(oxolan-2-ylmethyl)amine. Following Lipinski's Rule of Five, {6-Amino-5-nitro-2-[4-benzylpiperidyl]pyrimidin-4-yl}(oxolan-2-ylmethyl)amine 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 {6-Amino-5-nitro-2-[4-benzylpiperidyl]pyrimidin-4-yl}(oxolan-2-ylmethyl)amine?
The CAS number of {6-Amino-5-nitro-2-[4-benzylpiperidyl]pyrimidin-4-yl}(oxolan-2-ylmethyl)amine is 573930-70-8.
What is the molecular formula of {6-Amino-5-nitro-2-[4-benzylpiperidyl]pyrimidin-4-yl}(oxolan-2-ylmethyl)amine?
The molecular formula of {6-Amino-5-nitro-2-[4-benzylpiperidyl]pyrimidin-4-yl}(oxolan-2-ylmethyl)amine is C21H28N6O3.
What is the molecular weight of {6-Amino-5-nitro-2-[4-benzylpiperidyl]pyrimidin-4-yl}(oxolan-2-ylmethyl)amine?
The molecular weight of {6-Amino-5-nitro-2-[4-benzylpiperidyl]pyrimidin-4-yl}(oxolan-2-ylmethyl)amine is 412.22 g/mol.
Where can I buy {6-Amino-5-nitro-2-[4-benzylpiperidyl]pyrimidin-4-yl}(oxolan-2-ylmethyl)amine?
You can request a quote for {6-Amino-5-nitro-2-[4-benzylpiperidyl]pyrimidin-4-yl}(oxolan-2-ylmethyl)amine 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}(oxolan-2-ylmethyl)amine?
Yes, KEHONG BIO provides custom synthesis services for {6-Amino-5-nitro-2-[4-benzylpiperidyl]pyrimidin-4-yl}(oxolan-2-ylmethyl)amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.