N,N'-ethane-1,2-diylbis(3-nitrobenzamide)
TL;DR: N,N'-ethane-1,2-diylbis(3-nitrobenzamide) (CAS 17243-05-9) is a chemical compound with molecular formula C16H14N4O6 and molecular weight 358.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-nitro-N-[2-[(3-nitrobenzoyl)amino]ethyl]benzamide
Also Known As: 1,2-bis-(3-nitro-benzoylamino)-ethane, N,N'-1,2-ethanediylbis(3-nitrobenzamide), N.N'-Bis-(3-nitro-benzoyl)-aethylendiamin, N,N'-ethane-1,2-diylbis(3-nitrobenzamide), 3-nitro-N-[2-[(3-nitrobenzoyl)amino]ethyl]benzamide
| Molecular Formula | C16H14N4O6 |
|---|---|
| Molecular Weight | 358.09 g/mol |
| LogP | 1.6628 |
| Topological Polar Surface Area | 144.48 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 358.09134 |
| Heavy Atoms | 26 |
| Complexity | 795.8234 |
Chemical Identifiers
| CAS Number | 17243-05-9 |
|---|---|
| SMILES | C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NCCNC(=O)C2=CC(=CC=C2)[N+](=O)[O-] |
Product Overview
N,N'-ethane-1,2-diylbis(3-nitrobenzamide) (CAS 17243-05-9), with molecular formula C16H14N4O6 and molecular weight 358.09 g/mol. IUPAC: 3-nitro-N-[2-[(3-nitrobenzoyl)amino]ethyl]benzamide.
Chemical Property Profile of N,N'-ethane-1,2-diylbis(3-nitrobenzamide)
Property Insights of N,N'-ethane-1,2-diylbis(3-nitrobenzamide)
The XLogP value of 1.6628 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,N'-ethane-1,2-diylbis(3-nitrobenzamide). The TPSA of 144.48 Ų indicates high polarity, suggesting N,N'-ethane-1,2-diylbis(3-nitrobenzamide) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N,N'-ethane-1,2-diylbis(3-nitrobenzamide) 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,N'-ethane-1,2-diylbis(3-nitrobenzamide)?
The CAS number of N,N'-ethane-1,2-diylbis(3-nitrobenzamide) is 17243-05-9.
What is the molecular formula of N,N'-ethane-1,2-diylbis(3-nitrobenzamide)?
The molecular formula of N,N'-ethane-1,2-diylbis(3-nitrobenzamide) is C16H14N4O6.
What is the molecular weight of N,N'-ethane-1,2-diylbis(3-nitrobenzamide)?
The molecular weight of N,N'-ethane-1,2-diylbis(3-nitrobenzamide) is 358.09 g/mol.
Where can I buy N,N'-ethane-1,2-diylbis(3-nitrobenzamide)?
You can request a quote for N,N'-ethane-1,2-diylbis(3-nitrobenzamide) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N'-ethane-1,2-diylbis(3-nitrobenzamide)?
Yes, KEHONG BIO provides custom synthesis services for N,N'-ethane-1,2-diylbis(3-nitrobenzamide) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.