![[4-[3-(4-Benzylpiperazin-1-yl)-4-nitrophenyl]piperazin-1-yl]-phenylmethanone structure](/static/products/847/847240-91-9.png)
[4-[3-(4-Benzylpiperazin-1-yl)-4-nitrophenyl]piperazin-1-yl]-phenylmethanone
TL;DR: [4-[3-(4-Benzylpiperazin-1-yl)-4-nitrophenyl]piperazin-1-yl]-phenylmethanone (CAS 847240-91-9) is a chemical compound with molecular formula C28H31N5O3 and molecular weight 485.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[3-(4-benzylpiperazin-1-yl)-4-nitrophenyl]piperazin-1-yl]-phenylmethanone
Also Known As: [4-[3-(4-benzylpiperazin-1-yl)-4-nitrophenyl]piperazin-1-yl]-phenylmethanone|[4-[3-(4-benzylpiperazin-1-yl)-4-nitro-phenyl]piperazin-1-yl]-phenyl-methanone|{4-[3-(4-benzylpiperazin-1-yl)-4-nitrophenyl]piperazin-1-yl}(phenyl)methanone
| Molecular Formula | C28H31N5O3 |
|---|---|
| Molecular Weight | 485.24 g/mol |
| LogP | 3.8794 |
| Topological Polar Surface Area | 73.17 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 485.24268 |
| Heavy Atoms | 36 |
| Complexity | 1188.3218 |
Chemical Identifiers
| CAS Number | 847240-91-9 |
|---|---|
| SMILES | C1CN(CCN1CC2=CC=CC=C2)C3=C(C=CC(=C3)N4CCN(CC4)C(=O)C5=CC=CC=C5)[N+](=O)[O-] |
Product Overview
[4-[3-(4-Benzylpiperazin-1-yl)-4-nitrophenyl]piperazin-1-yl]-phenylmethanone (CAS 847240-91-9), with molecular formula C28H31N5O3 and molecular weight 485.24 g/mol. IUPAC: [4-[3-(4-benzylpiperazin-1-yl)-4-nitrophenyl]piperazin-1-yl]-phenylmethanone.
Chemical Property Profile of [4-[3-(4-Benzylpiperazin-1-yl)-4-nitrophenyl]piperazin-1-yl]-phenylmethanone
Property Insights of [4-[3-(4-Benzylpiperazin-1-yl)-4-nitrophenyl]piperazin-1-yl]-phenylmethanone
The XLogP value of 3.8794 indicates that [4-[3-(4-Benzylpiperazin-1-yl)-4-nitrophenyl]piperazin-1-yl]-phenylmethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.17 Ų falls within the moderate polarity range, balancing permeability and solubility for [4-[3-(4-Benzylpiperazin-1-yl)-4-nitrophenyl]piperazin-1-yl]-phenylmethanone. Following Lipinski's Rule of Five, [4-[3-(4-Benzylpiperazin-1-yl)-4-nitrophenyl]piperazin-1-yl]-phenylmethanone has 0 hydrogen bond donor(s) and 6 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-[3-(4-Benzylpiperazin-1-yl)-4-nitrophenyl]piperazin-1-yl]-phenylmethanone?
The CAS number of [4-[3-(4-Benzylpiperazin-1-yl)-4-nitrophenyl]piperazin-1-yl]-phenylmethanone is 847240-91-9.
What is the molecular formula of [4-[3-(4-Benzylpiperazin-1-yl)-4-nitrophenyl]piperazin-1-yl]-phenylmethanone?
The molecular formula of [4-[3-(4-Benzylpiperazin-1-yl)-4-nitrophenyl]piperazin-1-yl]-phenylmethanone is C28H31N5O3.
What is the molecular weight of [4-[3-(4-Benzylpiperazin-1-yl)-4-nitrophenyl]piperazin-1-yl]-phenylmethanone?
The molecular weight of [4-[3-(4-Benzylpiperazin-1-yl)-4-nitrophenyl]piperazin-1-yl]-phenylmethanone is 485.24 g/mol.
Where can I buy [4-[3-(4-Benzylpiperazin-1-yl)-4-nitrophenyl]piperazin-1-yl]-phenylmethanone?
You can request a quote for [4-[3-(4-Benzylpiperazin-1-yl)-4-nitrophenyl]piperazin-1-yl]-phenylmethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [4-[3-(4-Benzylpiperazin-1-yl)-4-nitrophenyl]piperazin-1-yl]-phenylmethanone?
Yes, KEHONG BIO provides custom synthesis services for [4-[3-(4-Benzylpiperazin-1-yl)-4-nitrophenyl]piperazin-1-yl]-phenylmethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.