{4-Amino-5-nitro-6-[4-benzylpiperidyl]pyrimidin-2-yl}methylphenylamine
TL;DR: {4-Amino-5-nitro-6-[4-benzylpiperidyl]pyrimidin-2-yl}methylphenylamine (CAS 714255-93-3) 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.
6-(4-benzylpiperidin-1-yl)-2-N-methyl-5-nitro-2-N-phenylpyrimidine-2,4-diamine
Also Known As: {4-amino-5-nitro-6-[4-benzylpiperidyl]pyrimidin-2-yl}methylphenylamine, 6-(4-benzylpiperidin-1-yl)-2-N-methyl-5-nitro-2-N-phenylpyrimidine-2,4-diamine, 6-(4-benzylpiperidin-1-yl)-N~2~-methyl-5-nitro-N~2~-phenylpyrimidine-2,4-diamine, 6-(4-BENZYLPIPERIDIN-1-YL)-N2-METHYL-5-NITRO-N2-PHENYLPYRIMIDINE-2,4-DIAMINE
| Molecular Formula | C23H26N6O2 |
|---|---|
| Molecular Weight | 418.21 g/mol |
| LogP | 4.194 |
| Topological Polar Surface Area | 101.42 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 418.21173 |
| Heavy Atoms | 31 |
| Complexity | 1036.6921 |
Chemical Identifiers
| CAS Number | 714255-93-3 |
|---|---|
| SMILES | CN(C1=CC=CC=C1)C2=NC(=C(C(=N2)N3CCC(CC3)CC4=CC=CC=C4)[N+](=O)[O-])N |
Product Overview
{4-Amino-5-nitro-6-[4-benzylpiperidyl]pyrimidin-2-yl}methylphenylamine (CAS 714255-93-3), with molecular formula C23H26N6O2 and molecular weight 418.21 g/mol. IUPAC: 6-(4-benzylpiperidin-1-yl)-2-N-methyl-5-nitro-2-N-phenylpyrimidine-2,4-diamine.
Chemical Property Profile of {4-Amino-5-nitro-6-[4-benzylpiperidyl]pyrimidin-2-yl}methylphenylamine
Property Insights of {4-Amino-5-nitro-6-[4-benzylpiperidyl]pyrimidin-2-yl}methylphenylamine
The XLogP value of 4.194 indicates that {4-Amino-5-nitro-6-[4-benzylpiperidyl]pyrimidin-2-yl}methylphenylamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.42 Ų falls within the moderate polarity range, balancing permeability and solubility for {4-Amino-5-nitro-6-[4-benzylpiperidyl]pyrimidin-2-yl}methylphenylamine. Following Lipinski's Rule of Five, {4-Amino-5-nitro-6-[4-benzylpiperidyl]pyrimidin-2-yl}methylphenylamine has 1 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 {4-Amino-5-nitro-6-[4-benzylpiperidyl]pyrimidin-2-yl}methylphenylamine?
The CAS number of {4-Amino-5-nitro-6-[4-benzylpiperidyl]pyrimidin-2-yl}methylphenylamine is 714255-93-3.
What is the molecular formula of {4-Amino-5-nitro-6-[4-benzylpiperidyl]pyrimidin-2-yl}methylphenylamine?
The molecular formula of {4-Amino-5-nitro-6-[4-benzylpiperidyl]pyrimidin-2-yl}methylphenylamine is C23H26N6O2.
What is the molecular weight of {4-Amino-5-nitro-6-[4-benzylpiperidyl]pyrimidin-2-yl}methylphenylamine?
The molecular weight of {4-Amino-5-nitro-6-[4-benzylpiperidyl]pyrimidin-2-yl}methylphenylamine is 418.21 g/mol.
Where can I buy {4-Amino-5-nitro-6-[4-benzylpiperidyl]pyrimidin-2-yl}methylphenylamine?
You can request a quote for {4-Amino-5-nitro-6-[4-benzylpiperidyl]pyrimidin-2-yl}methylphenylamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for {4-Amino-5-nitro-6-[4-benzylpiperidyl]pyrimidin-2-yl}methylphenylamine?
Yes, KEHONG BIO provides custom synthesis services for {4-Amino-5-nitro-6-[4-benzylpiperidyl]pyrimidin-2-yl}methylphenylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.