![(3-Fluorophenyl)[4-(2-nitrobenzyl)piperazin-1-yl]methanone structure](/static/products/3545/354535-72-1.webp)
(3-Fluorophenyl)[4-(2-nitrobenzyl)piperazin-1-yl]methanone
TL;DR: (3-Fluorophenyl)[4-(2-nitrobenzyl)piperazin-1-yl]methanone (CAS 354535-72-1) is a chemical compound with molecular formula C18H18FN3O3 and molecular weight 343.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-fluorophenyl)-[4-[(2-nitrophenyl)methyl]piperazin-1-yl]methanone
Also Known As: (3-fluorophenyl)[4-(2-nitrobenzyl)piperazin-1-yl]methanone, AB00098334-01, (3-fluorophenyl)-[4-[(2-nitrophenyl)methyl]piperazin-1-yl]methanone, 1-(3-FLUOROBENZOYL)-4-[(2-NITROPHENYL)METHYL]PIPERAZINE, 1-[(3-fluorophenyl)carbonyl]-4-({2-nitrophenyl}methyl)piperazine
| Molecular Formula | C18H18FN3O3 |
|---|---|
| Molecular Weight | 343.13 g/mol |
| LogP | 2.6919 |
| Topological Polar Surface Area | 66.69 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 343.1332 |
| Heavy Atoms | 25 |
| Complexity | 788.6407 |
Chemical Identifiers
| CAS Number | 354535-72-1 |
|---|---|
| SMILES | C1CN(CCN1CC2=CC=CC=C2[N+](=O)[O-])C(=O)C3=CC(=CC=C3)F |
Product Overview
(3-Fluorophenyl)[4-(2-nitrobenzyl)piperazin-1-yl]methanone (CAS 354535-72-1), with molecular formula C18H18FN3O3 and molecular weight 343.13 g/mol. IUPAC: (3-fluorophenyl)-[4-[(2-nitrophenyl)methyl]piperazin-1-yl]methanone.
Chemical Property Profile of (3-Fluorophenyl)[4-(2-nitrobenzyl)piperazin-1-yl]methanone
Property Insights of (3-Fluorophenyl)[4-(2-nitrobenzyl)piperazin-1-yl]methanone
The XLogP value of 2.6919 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3-Fluorophenyl)[4-(2-nitrobenzyl)piperazin-1-yl]methanone. The TPSA of 66.69 Ų falls within the moderate polarity range, balancing permeability and solubility for (3-Fluorophenyl)[4-(2-nitrobenzyl)piperazin-1-yl]methanone. Following Lipinski's Rule of Five, (3-Fluorophenyl)[4-(2-nitrobenzyl)piperazin-1-yl]methanone has 0 hydrogen bond donor(s) and 4 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 (3-Fluorophenyl)[4-(2-nitrobenzyl)piperazin-1-yl]methanone?
The CAS number of (3-Fluorophenyl)[4-(2-nitrobenzyl)piperazin-1-yl]methanone is 354535-72-1.
What is the molecular formula of (3-Fluorophenyl)[4-(2-nitrobenzyl)piperazin-1-yl]methanone?
The molecular formula of (3-Fluorophenyl)[4-(2-nitrobenzyl)piperazin-1-yl]methanone is C18H18FN3O3.
What is the molecular weight of (3-Fluorophenyl)[4-(2-nitrobenzyl)piperazin-1-yl]methanone?
The molecular weight of (3-Fluorophenyl)[4-(2-nitrobenzyl)piperazin-1-yl]methanone is 343.13 g/mol.
Where can I buy (3-Fluorophenyl)[4-(2-nitrobenzyl)piperazin-1-yl]methanone?
You can request a quote for (3-Fluorophenyl)[4-(2-nitrobenzyl)piperazin-1-yl]methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3-Fluorophenyl)[4-(2-nitrobenzyl)piperazin-1-yl]methanone?
Yes, KEHONG BIO provides custom synthesis services for (3-Fluorophenyl)[4-(2-nitrobenzyl)piperazin-1-yl]methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.