Benzamide, N-(2,4-dinitrophenyl)-4-nitro-
TL;DR: Benzamide, N-(2,4-dinitrophenyl)-4-nitro- (CAS 53665-01-3) is a chemical compound with molecular formula C13H8N4O7 and molecular weight 332.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,4-dinitrophenyl)-4-nitrobenzamide
Also Known As: N-(2,4-Dinitrophenyl)-4-nitrobenzamide, Benzanilide, 2',4,4'-trinitro-, 2',4',4-trinitrobenzanilide, Benzanilide,2',4,4'-trinitro, Benzamide, N-(2,4-dinitrophenyl)-4-nitro-
| Molecular Formula | C13H8N4O7 |
|---|---|
| Molecular Weight | 332.04 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 167.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 332.0393 |
| Heavy Atoms | 24 |
| Complexity | 516.0 |
Chemical Identifiers
| CAS Number | 53665-01-3 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | HNTAKXSYJOAFSG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzamide, N-(2,4-dinitrophenyl)-4-nitro- (CAS 53665-01-3), with molecular formula C13H8N4O7 and molecular weight 332.04 g/mol. IUPAC: N-(2,4-dinitrophenyl)-4-nitrobenzamide.
Chemical Property Profile of Benzamide, N-(2,4-dinitrophenyl)-4-nitro-
Property Insights of Benzamide, N-(2,4-dinitrophenyl)-4-nitro-
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzamide, N-(2,4-dinitrophenyl)-4-nitro-. The TPSA of 167.0 Ų indicates high polarity, suggesting Benzamide, N-(2,4-dinitrophenyl)-4-nitro- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Benzamide, N-(2,4-dinitrophenyl)-4-nitro- has 1 hydrogen bond donor(s) and 7 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 Benzamide, N-(2,4-dinitrophenyl)-4-nitro-?
The CAS number of Benzamide, N-(2,4-dinitrophenyl)-4-nitro- is 53665-01-3.
What is the molecular formula of Benzamide, N-(2,4-dinitrophenyl)-4-nitro-?
The molecular formula of Benzamide, N-(2,4-dinitrophenyl)-4-nitro- is C13H8N4O7.
What is the molecular weight of Benzamide, N-(2,4-dinitrophenyl)-4-nitro-?
The molecular weight of Benzamide, N-(2,4-dinitrophenyl)-4-nitro- is 332.04 g/mol.
Where can I buy Benzamide, N-(2,4-dinitrophenyl)-4-nitro-?
You can request a quote for Benzamide, N-(2,4-dinitrophenyl)-4-nitro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzamide, N-(2,4-dinitrophenyl)-4-nitro-?
Yes, KEHONG BIO provides custom synthesis services for Benzamide, N-(2,4-dinitrophenyl)-4-nitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.