![1-[4-[3-(Benzylamino)-4-nitrophenyl]piperazin-1-yl]ethanone structure](/static/products/3473/347356-35-8.webp)
1-[4-[3-(Benzylamino)-4-nitrophenyl]piperazin-1-yl]ethanone
TL;DR: 1-[4-[3-(Benzylamino)-4-nitrophenyl]piperazin-1-yl]ethanone (CAS 347356-35-8) is a chemical compound with molecular formula C19H22N4O3 and molecular weight 354.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-[3-(benzylamino)-4-nitrophenyl]piperazin-1-yl]ethanone
Also Known As: 1-acetyl-4-{3-(benzylamino)-4-nitrophenyl}piperazine, 1-[4-[3-(benzylamino)-4-nitrophenyl]piperazin-1-yl]ethanone, 1-acetyl-4-{4-nitro-3-[benzylamino]phenyl}piperazine, A2547/0108426, 1-(4-(3-(benzylamino)-4-nitrophenyl)piperazin-1-yl)ethanone
| Molecular Formula | C19H22N4O3 |
|---|---|
| Molecular Weight | 354.17 g/mol |
| LogP | 2.8754 |
| Topological Polar Surface Area | 78.72 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 354.1692 |
| Heavy Atoms | 26 |
| Complexity | 786.62616 |
Chemical Identifiers
| CAS Number | 347356-35-8 |
|---|---|
| SMILES | CC(=O)N1CCN(CC1)C2=CC(=C(C=C2)[N+](=O)[O-])NCC3=CC=CC=C3 |
Product Overview
1-[4-[3-(Benzylamino)-4-nitrophenyl]piperazin-1-yl]ethanone (CAS 347356-35-8), with molecular formula C19H22N4O3 and molecular weight 354.17 g/mol. IUPAC: 1-[4-[3-(benzylamino)-4-nitrophenyl]piperazin-1-yl]ethanone.
Chemical Property Profile of 1-[4-[3-(Benzylamino)-4-nitrophenyl]piperazin-1-yl]ethanone
Property Insights of 1-[4-[3-(Benzylamino)-4-nitrophenyl]piperazin-1-yl]ethanone
The XLogP value of 2.8754 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[4-[3-(Benzylamino)-4-nitrophenyl]piperazin-1-yl]ethanone. The TPSA of 78.72 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[4-[3-(Benzylamino)-4-nitrophenyl]piperazin-1-yl]ethanone. Following Lipinski's Rule of Five, 1-[4-[3-(Benzylamino)-4-nitrophenyl]piperazin-1-yl]ethanone has 1 hydrogen bond donor(s) and 5 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 1-[4-[3-(Benzylamino)-4-nitrophenyl]piperazin-1-yl]ethanone?
The CAS number of 1-[4-[3-(Benzylamino)-4-nitrophenyl]piperazin-1-yl]ethanone is 347356-35-8.
What is the molecular formula of 1-[4-[3-(Benzylamino)-4-nitrophenyl]piperazin-1-yl]ethanone?
The molecular formula of 1-[4-[3-(Benzylamino)-4-nitrophenyl]piperazin-1-yl]ethanone is C19H22N4O3.
What is the molecular weight of 1-[4-[3-(Benzylamino)-4-nitrophenyl]piperazin-1-yl]ethanone?
The molecular weight of 1-[4-[3-(Benzylamino)-4-nitrophenyl]piperazin-1-yl]ethanone is 354.17 g/mol.
Where can I buy 1-[4-[3-(Benzylamino)-4-nitrophenyl]piperazin-1-yl]ethanone?
You can request a quote for 1-[4-[3-(Benzylamino)-4-nitrophenyl]piperazin-1-yl]ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[4-[3-(Benzylamino)-4-nitrophenyl]piperazin-1-yl]ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-[4-[3-(Benzylamino)-4-nitrophenyl]piperazin-1-yl]ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.