1,4-Bis(3-benzyl-2-methyl-5-nitroimidazol-4-yl)piperazine
TL;DR: 1,4-Bis(3-benzyl-2-methyl-5-nitroimidazol-4-yl)piperazine (CAS 313402-39-0) is a chemical compound with molecular formula C26H28N8O4 and molecular weight 516.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4-bis(3-benzyl-2-methyl-5-nitroimidazol-4-yl)piperazine
Also Known As: 1,4-bis(3-benzyl-2-methyl-5-nitroimidazol-4-yl)piperazine, AH-034/32856027, 1,4-bis(1-benzyl-2-methyl-4-nitro-1H-imidazol-5-yl)piperazine, 1,4-bis{1-benzyl-4-nitro-2-methyl-1H-imidazol-5-yl}piperazine
| Molecular Formula | C26H28N8O4 |
|---|---|
| Molecular Weight | 516.22 g/mol |
| LogP | 3.93604 |
| Topological Polar Surface Area | 128.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 516.2233 |
| Heavy Atoms | 38 |
| Complexity | 1345.897 |
Chemical Identifiers
| CAS Number | 313402-39-0 |
|---|---|
| SMILES | CC1=NC(=C(N1CC2=CC=CC=C2)N3CCN(CC3)C4=C(N=C(N4CC5=CC=CC=C5)C)[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
1,4-Bis(3-benzyl-2-methyl-5-nitroimidazol-4-yl)piperazine (CAS 313402-39-0), with molecular formula C26H28N8O4 and molecular weight 516.22 g/mol. IUPAC: 1,4-bis(3-benzyl-2-methyl-5-nitroimidazol-4-yl)piperazine.
Chemical Property Profile of 1,4-Bis(3-benzyl-2-methyl-5-nitroimidazol-4-yl)piperazine
Property Insights of 1,4-Bis(3-benzyl-2-methyl-5-nitroimidazol-4-yl)piperazine
The XLogP value of 3.93604 indicates that 1,4-Bis(3-benzyl-2-methyl-5-nitroimidazol-4-yl)piperazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 128.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,4-Bis(3-benzyl-2-methyl-5-nitroimidazol-4-yl)piperazine. Following Lipinski's Rule of Five, 1,4-Bis(3-benzyl-2-methyl-5-nitroimidazol-4-yl)piperazine has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,4-Bis(3-benzyl-2-methyl-5-nitroimidazol-4-yl)piperazine?
The CAS number of 1,4-Bis(3-benzyl-2-methyl-5-nitroimidazol-4-yl)piperazine is 313402-39-0.
What is the molecular formula of 1,4-Bis(3-benzyl-2-methyl-5-nitroimidazol-4-yl)piperazine?
The molecular formula of 1,4-Bis(3-benzyl-2-methyl-5-nitroimidazol-4-yl)piperazine is C26H28N8O4.
What is the molecular weight of 1,4-Bis(3-benzyl-2-methyl-5-nitroimidazol-4-yl)piperazine?
The molecular weight of 1,4-Bis(3-benzyl-2-methyl-5-nitroimidazol-4-yl)piperazine is 516.22 g/mol.
Where can I buy 1,4-Bis(3-benzyl-2-methyl-5-nitroimidazol-4-yl)piperazine?
You can request a quote for 1,4-Bis(3-benzyl-2-methyl-5-nitroimidazol-4-yl)piperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Bis(3-benzyl-2-methyl-5-nitroimidazol-4-yl)piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Bis(3-benzyl-2-methyl-5-nitroimidazol-4-yl)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.