![4-Bromo-2-[[4-[(2-nitrophenyl)methyl]piperazin-1-yl]methyl]phenol structure](/static/products/4248/424800-36-2.webp)
4-Bromo-2-[[4-[(2-nitrophenyl)methyl]piperazin-1-yl]methyl]phenol
TL;DR: 4-Bromo-2-[[4-[(2-nitrophenyl)methyl]piperazin-1-yl]methyl]phenol (CAS 424800-36-2) is a chemical compound with molecular formula C18H20BrN3O3 and molecular weight 405.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-bromo-2-[[4-[(2-nitrophenyl)methyl]piperazin-1-yl]methyl]phenol
Also Known As: BIM-0004035.P001, AB00102504-01, 4-bromo-2-[[4-[(2-nitrophenyl)methyl]piperazin-1-yl]methyl]phenol, 4-bromo-2-{[4-(2-nitrobenzyl)piperazin-1-yl]methyl}phenol, 4-BROMO-2-{[4-(2-NITROBENZYL)PIPERAZINO]METHYL}PHENOL
| Molecular Formula | C18H20BrN3O3 |
|---|---|
| Molecular Weight | 405.07 g/mol |
| LogP | 3.3807 |
| Topological Polar Surface Area | 69.85 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 405.0688 |
| Heavy Atoms | 25 |
| Complexity | 760.98157 |
Chemical Identifiers
| CAS Number | 424800-36-2 |
|---|---|
| SMILES | C1CN(CCN1CC2=CC=CC=C2[N+](=O)[O-])CC3=C(C=CC(=C3)Br)O |
Product Overview
4-Bromo-2-[[4-[(2-nitrophenyl)methyl]piperazin-1-yl]methyl]phenol (CAS 424800-36-2), with molecular formula C18H20BrN3O3 and molecular weight 405.07 g/mol. IUPAC: 4-bromo-2-[[4-[(2-nitrophenyl)methyl]piperazin-1-yl]methyl]phenol.
Chemical Property Profile of 4-Bromo-2-[[4-[(2-nitrophenyl)methyl]piperazin-1-yl]methyl]phenol
Property Insights of 4-Bromo-2-[[4-[(2-nitrophenyl)methyl]piperazin-1-yl]methyl]phenol
The XLogP value of 3.3807 indicates that 4-Bromo-2-[[4-[(2-nitrophenyl)methyl]piperazin-1-yl]methyl]phenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.85 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Bromo-2-[[4-[(2-nitrophenyl)methyl]piperazin-1-yl]methyl]phenol. Following Lipinski's Rule of Five, 4-Bromo-2-[[4-[(2-nitrophenyl)methyl]piperazin-1-yl]methyl]phenol 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 4-Bromo-2-[[4-[(2-nitrophenyl)methyl]piperazin-1-yl]methyl]phenol?
The CAS number of 4-Bromo-2-[[4-[(2-nitrophenyl)methyl]piperazin-1-yl]methyl]phenol is 424800-36-2.
What is the molecular formula of 4-Bromo-2-[[4-[(2-nitrophenyl)methyl]piperazin-1-yl]methyl]phenol?
The molecular formula of 4-Bromo-2-[[4-[(2-nitrophenyl)methyl]piperazin-1-yl]methyl]phenol is C18H20BrN3O3.
What is the molecular weight of 4-Bromo-2-[[4-[(2-nitrophenyl)methyl]piperazin-1-yl]methyl]phenol?
The molecular weight of 4-Bromo-2-[[4-[(2-nitrophenyl)methyl]piperazin-1-yl]methyl]phenol is 405.07 g/mol.
Where can I buy 4-Bromo-2-[[4-[(2-nitrophenyl)methyl]piperazin-1-yl]methyl]phenol?
You can request a quote for 4-Bromo-2-[[4-[(2-nitrophenyl)methyl]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-Bromo-2-[[4-[(2-nitrophenyl)methyl]piperazin-1-yl]methyl]phenol?
Yes, KEHONG BIO provides custom synthesis services for 4-Bromo-2-[[4-[(2-nitrophenyl)methyl]piperazin-1-yl]methyl]phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.