![{4-Amino-5-nitro-6-[4-benzylpiperazinyl]pyrimidin-2-yl}(2-phenylethyl)amine structure](/static/products/714/714253-53-9.png)
{4-Amino-5-nitro-6-[4-benzylpiperazinyl]pyrimidin-2-yl}(2-phenylethyl)amine
TL;DR: {4-Amino-5-nitro-6-[4-benzylpiperazinyl]pyrimidin-2-yl}(2-phenylethyl)amine (CAS 714253-53-9) is a chemical compound with molecular formula C23H27N7O2 and molecular weight 433.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(4-benzylpiperazin-1-yl)-5-nitro-2-N-(2-phenylethyl)pyrimidine-2,4-diamine
Also Known As: UPCMLD0ENAT5865497:001, 6-(4-benzylpiperazin-1-yl)-5-nitro-2-N-phenethylpyrimidine-2,4-diamine, 6-(4-benzylpiperazin-1-yl)-5-nitro-N-phenethyl-pyrimidine-2,4-diamine, 6-(4-benzylpiperazin-1-yl)-5-nitro-N2-phenethylpyrimidine-2,4-diamine, {4-amino-5-nitro-6-[4-benzylpiperazinyl]pyrimidin-2-yl}(2-phenylethyl)amine
| Molecular Formula | C23H27N7O2 |
|---|---|
| Molecular Weight | 433.22 g/mol |
| LogP | 2.9438 |
| Topological Polar Surface Area | 113.45 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 433.22263 |
| Heavy Atoms | 32 |
| Complexity | 1038.9703 |
Chemical Identifiers
| CAS Number | 714253-53-9 |
|---|---|
| SMILES | C1CN(CCN1CC2=CC=CC=C2)C3=NC(=NC(=C3[N+](=O)[O-])N)NCCC4=CC=CC=C4 |
Product Overview
{4-Amino-5-nitro-6-[4-benzylpiperazinyl]pyrimidin-2-yl}(2-phenylethyl)amine (CAS 714253-53-9), with molecular formula C23H27N7O2 and molecular weight 433.22 g/mol. IUPAC: 6-(4-benzylpiperazin-1-yl)-5-nitro-2-N-(2-phenylethyl)pyrimidine-2,4-diamine.
Chemical Property Profile of {4-Amino-5-nitro-6-[4-benzylpiperazinyl]pyrimidin-2-yl}(2-phenylethyl)amine
Property Insights of {4-Amino-5-nitro-6-[4-benzylpiperazinyl]pyrimidin-2-yl}(2-phenylethyl)amine
The XLogP value of 2.9438 suggests moderate lipophilicity, balancing water solubility and membrane permeability for {4-Amino-5-nitro-6-[4-benzylpiperazinyl]pyrimidin-2-yl}(2-phenylethyl)amine. The TPSA of 113.45 Ų falls within the moderate polarity range, balancing permeability and solubility for {4-Amino-5-nitro-6-[4-benzylpiperazinyl]pyrimidin-2-yl}(2-phenylethyl)amine. Following Lipinski's Rule of Five, {4-Amino-5-nitro-6-[4-benzylpiperazinyl]pyrimidin-2-yl}(2-phenylethyl)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 {4-Amino-5-nitro-6-[4-benzylpiperazinyl]pyrimidin-2-yl}(2-phenylethyl)amine?
The CAS number of {4-Amino-5-nitro-6-[4-benzylpiperazinyl]pyrimidin-2-yl}(2-phenylethyl)amine is 714253-53-9.
What is the molecular formula of {4-Amino-5-nitro-6-[4-benzylpiperazinyl]pyrimidin-2-yl}(2-phenylethyl)amine?
The molecular formula of {4-Amino-5-nitro-6-[4-benzylpiperazinyl]pyrimidin-2-yl}(2-phenylethyl)amine is C23H27N7O2.
What is the molecular weight of {4-Amino-5-nitro-6-[4-benzylpiperazinyl]pyrimidin-2-yl}(2-phenylethyl)amine?
The molecular weight of {4-Amino-5-nitro-6-[4-benzylpiperazinyl]pyrimidin-2-yl}(2-phenylethyl)amine is 433.22 g/mol.
Where can I buy {4-Amino-5-nitro-6-[4-benzylpiperazinyl]pyrimidin-2-yl}(2-phenylethyl)amine?
You can request a quote for {4-Amino-5-nitro-6-[4-benzylpiperazinyl]pyrimidin-2-yl}(2-phenylethyl)amine 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-benzylpiperazinyl]pyrimidin-2-yl}(2-phenylethyl)amine?
Yes, KEHONG BIO provides custom synthesis services for {4-Amino-5-nitro-6-[4-benzylpiperazinyl]pyrimidin-2-yl}(2-phenylethyl)amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.