![1-[(5-Nitro-2-furyl)methyl]-4-(4-nitrophenyl)piperazine oxalate structure](/static/products/118/1185709-64-1.png)
1-[(5-Nitro-2-furyl)methyl]-4-(4-nitrophenyl)piperazine oxalate
TL;DR: 1-[(5-Nitro-2-furyl)methyl]-4-(4-nitrophenyl)piperazine oxalate (CAS 1185709-64-1) is a chemical compound with molecular formula C17H18N4O9 and molecular weight 422.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(5-nitrofuran-2-yl)methyl]-4-(4-nitrophenyl)piperazine;oxalic acid
Also Known As: 1-[(5-nitro-2-furyl)methyl]-4-(4-nitrophenyl)piperazine oxalate, 1-[(5-nitrofuran-2-yl)methyl]-4-(4-nitrophenyl)piperazine; oxalic acid, 1-[(5-nitrofuran-2-yl)methyl]-4-(4-nitrophenyl)piperazine;oxalic acid, IUPAC: 1-[(5-nitro-2-furyl)methyl]-4-(4-nitrophenyl)piperazine; Oxalic Acid
| Molecular Formula | C17H18N4O9 |
|---|---|
| Molecular Weight | 422.11 g/mol |
| LogP | 1.5738 |
| Topological Polar Surface Area | 180.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 5 |
| Exact Mass | 422.1074 |
| Heavy Atoms | 30 |
| Complexity | 905.565 |
Chemical Identifiers
| CAS Number | 1185709-64-1 |
|---|---|
| SMILES | C1CN(CCN1CC2=CC=C(O2)[N+](=O)[O-])C3=CC=C(C=C3)[N+](=O)[O-].C(=O)(C(=O)O)O |
Product Overview
1-[(5-Nitro-2-furyl)methyl]-4-(4-nitrophenyl)piperazine oxalate (CAS 1185709-64-1), with molecular formula C17H18N4O9 and molecular weight 422.11 g/mol. IUPAC: 1-[(5-nitrofuran-2-yl)methyl]-4-(4-nitrophenyl)piperazine;oxalic acid.
Chemical Property Profile of 1-[(5-Nitro-2-furyl)methyl]-4-(4-nitrophenyl)piperazine oxalate
Property Insights of 1-[(5-Nitro-2-furyl)methyl]-4-(4-nitrophenyl)piperazine oxalate
The XLogP value of 1.5738 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[(5-Nitro-2-furyl)methyl]-4-(4-nitrophenyl)piperazine oxalate. The TPSA of 180.5 Ų indicates high polarity, suggesting 1-[(5-Nitro-2-furyl)methyl]-4-(4-nitrophenyl)piperazine oxalate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1-[(5-Nitro-2-furyl)methyl]-4-(4-nitrophenyl)piperazine oxalate has 2 hydrogen bond donor(s) and 9 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-Nitro-2-furyl)methyl]-4-(4-nitrophenyl)piperazine oxalate?
The CAS number of 1-[(5-Nitro-2-furyl)methyl]-4-(4-nitrophenyl)piperazine oxalate is 1185709-64-1.
What is the molecular formula of 1-[(5-Nitro-2-furyl)methyl]-4-(4-nitrophenyl)piperazine oxalate?
The molecular formula of 1-[(5-Nitro-2-furyl)methyl]-4-(4-nitrophenyl)piperazine oxalate is C17H18N4O9.
What is the molecular weight of 1-[(5-Nitro-2-furyl)methyl]-4-(4-nitrophenyl)piperazine oxalate?
The molecular weight of 1-[(5-Nitro-2-furyl)methyl]-4-(4-nitrophenyl)piperazine oxalate is 422.11 g/mol.
Where can I buy 1-[(5-Nitro-2-furyl)methyl]-4-(4-nitrophenyl)piperazine oxalate?
You can request a quote for 1-[(5-Nitro-2-furyl)methyl]-4-(4-nitrophenyl)piperazine oxalate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(5-Nitro-2-furyl)methyl]-4-(4-nitrophenyl)piperazine oxalate?
Yes, KEHONG BIO provides custom synthesis services for 1-[(5-Nitro-2-furyl)methyl]-4-(4-nitrophenyl)piperazine oxalate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.