4-Methoxy-2-{[4-(4-nitrobenzyl)piperazin-1-yl]methyl}phenol
TL;DR: 4-Methoxy-2-{[4-(4-nitrobenzyl)piperazin-1-yl]methyl}phenol (CAS 425372-68-5) is a chemical compound with molecular formula C19H23N3O4 and molecular weight 357.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methoxy-2-[[4-[(4-nitrophenyl)methyl]piperazin-1-yl]methyl]phenol
Also Known As: BAS 03050941, BIM-0019721.P001, 4-Methoxy-2-[4-(4-nitro-benzyl)-piperazin-1-ylmethyl]-phenol, 4-methoxy-2-{[4-(4-nitrobenzyl)piperazin-1-yl]methyl}phenol, 4-METHOXY-2-{[4-(4-NITROBENZYL)PIPERAZINO]METHYL}PHENOL
| Molecular Formula | C19H23N3O4 |
|---|---|
| Molecular Weight | 357.17 g/mol |
| LogP | 2.6268 |
| Topological Polar Surface Area | 79.08 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 357.16885 |
| Heavy Atoms | 26 |
| Complexity | 755.8796 |
Chemical Identifiers
| CAS Number | 425372-68-5 |
|---|---|
| SMILES | COC1=CC(=C(C=C1)O)CN2CCN(CC2)CC3=CC=C(C=C3)[N+](=O)[O-] |
Product Overview
4-Methoxy-2-{[4-(4-nitrobenzyl)piperazin-1-yl]methyl}phenol (CAS 425372-68-5), with molecular formula C19H23N3O4 and molecular weight 357.17 g/mol. IUPAC: 4-methoxy-2-[[4-[(4-nitrophenyl)methyl]piperazin-1-yl]methyl]phenol.
Chemical Property Profile of 4-Methoxy-2-{[4-(4-nitrobenzyl)piperazin-1-yl]methyl}phenol
Property Insights of 4-Methoxy-2-{[4-(4-nitrobenzyl)piperazin-1-yl]methyl}phenol
The XLogP value of 2.6268 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Methoxy-2-{[4-(4-nitrobenzyl)piperazin-1-yl]methyl}phenol. The TPSA of 79.08 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Methoxy-2-{[4-(4-nitrobenzyl)piperazin-1-yl]methyl}phenol. Following Lipinski's Rule of Five, 4-Methoxy-2-{[4-(4-nitrobenzyl)piperazin-1-yl]methyl}phenol has 1 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-Methoxy-2-{[4-(4-nitrobenzyl)piperazin-1-yl]methyl}phenol?
The CAS number of 4-Methoxy-2-{[4-(4-nitrobenzyl)piperazin-1-yl]methyl}phenol is 425372-68-5.
What is the molecular formula of 4-Methoxy-2-{[4-(4-nitrobenzyl)piperazin-1-yl]methyl}phenol?
The molecular formula of 4-Methoxy-2-{[4-(4-nitrobenzyl)piperazin-1-yl]methyl}phenol is C19H23N3O4.
What is the molecular weight of 4-Methoxy-2-{[4-(4-nitrobenzyl)piperazin-1-yl]methyl}phenol?
The molecular weight of 4-Methoxy-2-{[4-(4-nitrobenzyl)piperazin-1-yl]methyl}phenol is 357.17 g/mol.
Where can I buy 4-Methoxy-2-{[4-(4-nitrobenzyl)piperazin-1-yl]methyl}phenol?
You can request a quote for 4-Methoxy-2-{[4-(4-nitrobenzyl)piperazin-1-yl]methyl}phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methoxy-2-{[4-(4-nitrobenzyl)piperazin-1-yl]methyl}phenol?
Yes, KEHONG BIO provides custom synthesis services for 4-Methoxy-2-{[4-(4-nitrobenzyl)piperazin-1-yl]methyl}phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.