4-硝基-N-(3-硝基苯基)苯甲酰胺
TL;DR: 4-硝基-N-(3-硝基苯基)苯甲酰胺 (CAS 139-29-7) is a chemical compound with molecular formula C13H9N3O5 and molecular weight 287.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-硝基-N-(3-硝基苯基)苯甲酰胺
4-nitro-N-(3-nitrophenyl)benzamide
Also Known As: 3',4-Dinitrobenzanilide, 4-nitro-N-(3-nitrophenyl)benzamide, Benzamide, 4-nitro-N-(3-nitrophenyl)-, 4-Nitro-N-(3-nitro-phenyl)-benzamide, (4-nitrophenyl)-N-(3-nitrophenyl)carboxamide
| Molecular Formula | C13H9N3O5 |
|---|---|
| Molecular Weight | 287.05 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 121.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 287.05423 |
| Heavy Atoms | 21 |
| Complexity | 409.0 |
Chemical Identifiers
| CAS Number | 139-29-7 |
|---|---|
| SMILES | C1=CC(=CC(=C1)[N+](=O)[O-])NC(=O)C2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | LZBOEAUDEFYCDQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-硝基-N-(3-硝基苯基)苯甲酰胺 (CAS 139-29-7), with molecular formula C13H9N3O5 and molecular weight 287.05 g/mol. IUPAC: 4-nitro-N-(3-nitrophenyl)benzamide.
Chemical Property Profile of 4-硝基-N-(3-硝基苯基)苯甲酰胺
Property Insights of 4-硝基-N-(3-硝基苯基)苯甲酰胺
The XLogP value of 3.0 indicates that 4-硝基-N-(3-硝基苯基)苯甲酰胺 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 121.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-硝基-N-(3-硝基苯基)苯甲酰胺. Following Lipinski's Rule of Five, 4-硝基-N-(3-硝基苯基)苯甲酰胺 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 4-硝基-N-(3-硝基苯基)苯甲酰胺?
The CAS number of 4-硝基-N-(3-硝基苯基)苯甲酰胺 is 139-29-7.
What is the molecular formula of 4-硝基-N-(3-硝基苯基)苯甲酰胺?
The molecular formula of 4-硝基-N-(3-硝基苯基)苯甲酰胺 is C13H9N3O5.
What is the molecular weight of 4-硝基-N-(3-硝基苯基)苯甲酰胺?
The molecular weight of 4-硝基-N-(3-硝基苯基)苯甲酰胺 is 287.05 g/mol.
Where can I buy 4-硝基-N-(3-硝基苯基)苯甲酰胺?
You can request a quote for 4-硝基-N-(3-硝基苯基)苯甲酰胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-硝基-N-(3-硝基苯基)苯甲酰胺?
Yes, KEHONG BIO provides custom synthesis services for 4-硝基-N-(3-硝基苯基)苯甲酰胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.