N~1~,N~4~-Bis(4-nitrophenyl)piperazine-1,4-dicarboxamide
TL;DR: N~1~,N~4~-Bis(4-nitrophenyl)piperazine-1,4-dicarboxamide (CAS 103841-99-2) is a chemical compound with molecular formula C18H18N6O6 and molecular weight 414.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-N,4-N-bis(4-nitrophenyl)piperazine-1,4-dicarboxamide
Also Known As: n,n'-bis(4-nitrophenyl)piperazine-1,4-dicarboxamide, N~1~,N~4~-Bis(4-nitrophenyl)piperazine-1,4-dicarboxamide, 1-N,4-N-bis(4-nitrophenyl)piperazine-1,4-dicarboxamide
| Molecular Formula | C18H18N6O6 |
|---|---|
| Molecular Weight | 414.13 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 156.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 414.12878 |
| Heavy Atoms | 30 |
| Complexity | 585.0 |
Chemical Identifiers
| CAS Number | 103841-99-2 |
|---|---|
| SMILES | C1CN(CCN1C(=O)NC2=CC=C(C=C2)[N+](=O)[O-])C(=O)NC3=CC=C(C=C3)[N+](=O)[O-] |
| InChIKey | IMOFNYKBBDWGEE-UHFFFAOYSA-N |
Product Overview
N~1~,N~4~-Bis(4-nitrophenyl)piperazine-1,4-dicarboxamide (CAS 103841-99-2), with molecular formula C18H18N6O6 and molecular weight 414.13 g/mol. IUPAC: 1-N,4-N-bis(4-nitrophenyl)piperazine-1,4-dicarboxamide.
Chemical Property Profile of N~1~,N~4~-Bis(4-nitrophenyl)piperazine-1,4-dicarboxamide
Property Insights of N~1~,N~4~-Bis(4-nitrophenyl)piperazine-1,4-dicarboxamide
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N~1~,N~4~-Bis(4-nitrophenyl)piperazine-1,4-dicarboxamide. The TPSA of 156.0 Ų indicates high polarity, suggesting N~1~,N~4~-Bis(4-nitrophenyl)piperazine-1,4-dicarboxamide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N~1~,N~4~-Bis(4-nitrophenyl)piperazine-1,4-dicarboxamide has 2 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 N~1~,N~4~-Bis(4-nitrophenyl)piperazine-1,4-dicarboxamide?
The CAS number of N~1~,N~4~-Bis(4-nitrophenyl)piperazine-1,4-dicarboxamide is 103841-99-2.
What is the molecular formula of N~1~,N~4~-Bis(4-nitrophenyl)piperazine-1,4-dicarboxamide?
The molecular formula of N~1~,N~4~-Bis(4-nitrophenyl)piperazine-1,4-dicarboxamide is C18H18N6O6.
What is the molecular weight of N~1~,N~4~-Bis(4-nitrophenyl)piperazine-1,4-dicarboxamide?
The molecular weight of N~1~,N~4~-Bis(4-nitrophenyl)piperazine-1,4-dicarboxamide is 414.13 g/mol.
Where can I buy N~1~,N~4~-Bis(4-nitrophenyl)piperazine-1,4-dicarboxamide?
You can request a quote for N~1~,N~4~-Bis(4-nitrophenyl)piperazine-1,4-dicarboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N~1~,N~4~-Bis(4-nitrophenyl)piperazine-1,4-dicarboxamide?
Yes, KEHONG BIO provides custom synthesis services for N~1~,N~4~-Bis(4-nitrophenyl)piperazine-1,4-dicarboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.