1-[(2-Bromophenyl)methyl]-4-[(3-nitrophenyl)methyl]piperazine
TL;DR: 1-[(2-Bromophenyl)methyl]-4-[(3-nitrophenyl)methyl]piperazine (CAS 355396-10-0) is a chemical compound with molecular formula C18H20BrN3O2 and molecular weight 389.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(2-bromophenyl)methyl]-4-[(3-nitrophenyl)methyl]piperazine
Also Known As: BAS 01840305, 1-[(2-bromophenyl)methyl]-4-[(3-nitrophenyl)methyl]piperazine, 1-(2-bromobenzyl)-4-(3-nitrobenzyl)piperazine, 1-(2-bromobenzyl)-4-{3-nitrobenzyl}piperazine, 1-(2-Bromo-benzyl)-4-(3-nitro-benzyl)-piperazine
| Molecular Formula | C18H20BrN3O2 |
|---|---|
| Molecular Weight | 389.07 g/mol |
| LogP | 3.6751 |
| Topological Polar Surface Area | 49.62 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 389.07388 |
| Heavy Atoms | 24 |
| Complexity | 714.915 |
Chemical Identifiers
| CAS Number | 355396-10-0 |
|---|---|
| SMILES | C1CN(CCN1CC2=CC(=CC=C2)[N+](=O)[O-])CC3=CC=CC=C3Br |
Product Overview
1-[(2-Bromophenyl)methyl]-4-[(3-nitrophenyl)methyl]piperazine (CAS 355396-10-0), with molecular formula C18H20BrN3O2 and molecular weight 389.07 g/mol. IUPAC: 1-[(2-bromophenyl)methyl]-4-[(3-nitrophenyl)methyl]piperazine.
Chemical Property Profile of 1-[(2-Bromophenyl)methyl]-4-[(3-nitrophenyl)methyl]piperazine
Property Insights of 1-[(2-Bromophenyl)methyl]-4-[(3-nitrophenyl)methyl]piperazine
The XLogP value of 3.6751 indicates that 1-[(2-Bromophenyl)methyl]-4-[(3-nitrophenyl)methyl]piperazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.62 Ų, 1-[(2-Bromophenyl)methyl]-4-[(3-nitrophenyl)methyl]piperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[(2-Bromophenyl)methyl]-4-[(3-nitrophenyl)methyl]piperazine 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 1-[(2-Bromophenyl)methyl]-4-[(3-nitrophenyl)methyl]piperazine?
The CAS number of 1-[(2-Bromophenyl)methyl]-4-[(3-nitrophenyl)methyl]piperazine is 355396-10-0.
What is the molecular formula of 1-[(2-Bromophenyl)methyl]-4-[(3-nitrophenyl)methyl]piperazine?
The molecular formula of 1-[(2-Bromophenyl)methyl]-4-[(3-nitrophenyl)methyl]piperazine is C18H20BrN3O2.
What is the molecular weight of 1-[(2-Bromophenyl)methyl]-4-[(3-nitrophenyl)methyl]piperazine?
The molecular weight of 1-[(2-Bromophenyl)methyl]-4-[(3-nitrophenyl)methyl]piperazine is 389.07 g/mol.
Where can I buy 1-[(2-Bromophenyl)methyl]-4-[(3-nitrophenyl)methyl]piperazine?
You can request a quote for 1-[(2-Bromophenyl)methyl]-4-[(3-nitrophenyl)methyl]piperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(2-Bromophenyl)methyl]-4-[(3-nitrophenyl)methyl]piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-[(2-Bromophenyl)methyl]-4-[(3-nitrophenyl)methyl]piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.