2-chloro-5-nitro-N-(4-nitrophenyl)benzamide
TL;DR: 2-chloro-5-nitro-N-(4-nitrophenyl)benzamide (CAS 30456-06-5) is a chemical compound with molecular formula C13H8ClN3O5 and molecular weight 321.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-5-nitro-N-(4-nitrophenyl)benzamide
Also Known As: 2-chloro-5-nitro-N-(4-nitrophenyl)benzamide, 2-chloro-5-nitro-N-{4-nitrophenyl}benzamide, AE-848/32734054, (2-chloro-5-nitrophenyl)-N-(4-nitrophenyl)carboxamide
| Molecular Formula | C13H8ClN3O5 |
|---|---|
| Molecular Weight | 321.02 g/mol |
| LogP | 3.4087 |
| Topological Polar Surface Area | 115.38 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 321.01526 |
| Heavy Atoms | 22 |
| Complexity | 760.77094 |
Chemical Identifiers
| CAS Number | 30456-06-5 |
|---|---|
| SMILES | C1=CC(=CC=C1NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl)[N+](=O)[O-] |
Product Overview
2-chloro-5-nitro-N-(4-nitrophenyl)benzamide (CAS 30456-06-5), with molecular formula C13H8ClN3O5 and molecular weight 321.02 g/mol. IUPAC: 2-chloro-5-nitro-N-(4-nitrophenyl)benzamide.
Chemical Property Profile of 2-chloro-5-nitro-N-(4-nitrophenyl)benzamide
Property Insights of 2-chloro-5-nitro-N-(4-nitrophenyl)benzamide
The XLogP value of 3.4087 indicates that 2-chloro-5-nitro-N-(4-nitrophenyl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 115.38 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-chloro-5-nitro-N-(4-nitrophenyl)benzamide. Following Lipinski's Rule of Five, 2-chloro-5-nitro-N-(4-nitrophenyl)benzamide has 1 hydrogen bond donor(s) and 5 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 2-chloro-5-nitro-N-(4-nitrophenyl)benzamide?
The CAS number of 2-chloro-5-nitro-N-(4-nitrophenyl)benzamide is 30456-06-5.
What is the molecular formula of 2-chloro-5-nitro-N-(4-nitrophenyl)benzamide?
The molecular formula of 2-chloro-5-nitro-N-(4-nitrophenyl)benzamide is C13H8ClN3O5.
What is the molecular weight of 2-chloro-5-nitro-N-(4-nitrophenyl)benzamide?
The molecular weight of 2-chloro-5-nitro-N-(4-nitrophenyl)benzamide is 321.02 g/mol.
Where can I buy 2-chloro-5-nitro-N-(4-nitrophenyl)benzamide?
You can request a quote for 2-chloro-5-nitro-N-(4-nitrophenyl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-chloro-5-nitro-N-(4-nitrophenyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 2-chloro-5-nitro-N-(4-nitrophenyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.