1-(5-Bromo-2,4-dimethoxybenzyl)-4-(4-nitrophenyl)piperazine
TL;DR: 1-(5-Bromo-2,4-dimethoxybenzyl)-4-(4-nitrophenyl)piperazine (CAS 414876-04-3) is a chemical compound with molecular formula C19H22BrN3O4 and molecular weight 435.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(5-bromo-2,4-dimethoxyphenyl)methyl]-4-(4-nitrophenyl)piperazine
Also Known As: 1-(5-Bromo-2,4-dimethoxybenzyl)-4-(4-nitrophenyl)piperazine, 1-[(5-bromo-2,4-dimethoxy-phenyl)methyl]-4-(4-nitrophenyl)piperazine, 1-[(5-bromo-2,4-dimethoxyphenyl)methyl]-4-(4-nitrophenyl)piperazine, Cambridge id 5260093
| Molecular Formula | C19H22BrN3O4 |
|---|---|
| Molecular Weight | 435.08 g/mol |
| LogP | 3.6967 |
| Topological Polar Surface Area | 68.08 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 435.07938 |
| Heavy Atoms | 27 |
| Complexity | 805.3472 |
Chemical Identifiers
| CAS Number | 414876-04-3 |
|---|---|
| SMILES | COC1=CC(=C(C=C1CN2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-])Br)OC |
Product Overview
1-(5-Bromo-2,4-dimethoxybenzyl)-4-(4-nitrophenyl)piperazine (CAS 414876-04-3), with molecular formula C19H22BrN3O4 and molecular weight 435.08 g/mol. IUPAC: 1-[(5-bromo-2,4-dimethoxyphenyl)methyl]-4-(4-nitrophenyl)piperazine.
Chemical Property Profile of 1-(5-Bromo-2,4-dimethoxybenzyl)-4-(4-nitrophenyl)piperazine
Property Insights of 1-(5-Bromo-2,4-dimethoxybenzyl)-4-(4-nitrophenyl)piperazine
The XLogP value of 3.6967 indicates that 1-(5-Bromo-2,4-dimethoxybenzyl)-4-(4-nitrophenyl)piperazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.08 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(5-Bromo-2,4-dimethoxybenzyl)-4-(4-nitrophenyl)piperazine. Following Lipinski's Rule of Five, 1-(5-Bromo-2,4-dimethoxybenzyl)-4-(4-nitrophenyl)piperazine 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 1-(5-Bromo-2,4-dimethoxybenzyl)-4-(4-nitrophenyl)piperazine?
The CAS number of 1-(5-Bromo-2,4-dimethoxybenzyl)-4-(4-nitrophenyl)piperazine is 414876-04-3.
What is the molecular formula of 1-(5-Bromo-2,4-dimethoxybenzyl)-4-(4-nitrophenyl)piperazine?
The molecular formula of 1-(5-Bromo-2,4-dimethoxybenzyl)-4-(4-nitrophenyl)piperazine is C19H22BrN3O4.
What is the molecular weight of 1-(5-Bromo-2,4-dimethoxybenzyl)-4-(4-nitrophenyl)piperazine?
The molecular weight of 1-(5-Bromo-2,4-dimethoxybenzyl)-4-(4-nitrophenyl)piperazine is 435.08 g/mol.
Where can I buy 1-(5-Bromo-2,4-dimethoxybenzyl)-4-(4-nitrophenyl)piperazine?
You can request a quote for 1-(5-Bromo-2,4-dimethoxybenzyl)-4-(4-nitrophenyl)piperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(5-Bromo-2,4-dimethoxybenzyl)-4-(4-nitrophenyl)piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-(5-Bromo-2,4-dimethoxybenzyl)-4-(4-nitrophenyl)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.