4'-Nitrobenzanilide
TL;DR: 4'-Nitrobenzanilide (CAS 3393-96-2) is a chemical compound with molecular formula C13H10N2O3 and molecular weight 242.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-nitrophenyl)benzamide
Also Known As: 4'-Nitrobenzanilide, N-(4-Nitrophenyl)benzamide, 4-Nitrobenzanilide, p'-Nitrobenzanilide, Benzamide, N-(4-nitrophenyl)-
| Molecular Formula | C13H10N2O3 |
|---|---|
| Molecular Weight | 242.07 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 74.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 242.06914 |
| Heavy Atoms | 18 |
| Complexity | 300.0 |
| Solubility | 2.2 [ug/mL] (The mean of the results at pH 7.4) |
Chemical Identifiers
| CAS Number | 3393-96-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | GMGQGZYFQSCZCW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4'-Nitrobenzanilide (CAS 3393-96-2), with molecular formula C13H10N2O3 and molecular weight 242.07 g/mol. IUPAC: N-(4-nitrophenyl)benzamide.
Chemical Property Profile of 4'-Nitrobenzanilide
Property Insights of 4'-Nitrobenzanilide
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4'-Nitrobenzanilide. The TPSA of 74.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 4'-Nitrobenzanilide. Following Lipinski's Rule of Five, 4'-Nitrobenzanilide has 1 hydrogen bond donor(s) and 3 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'-Nitrobenzanilide?
The CAS number of 4'-Nitrobenzanilide is 3393-96-2.
What is the molecular formula of 4'-Nitrobenzanilide?
The molecular formula of 4'-Nitrobenzanilide is C13H10N2O3.
What is the molecular weight of 4'-Nitrobenzanilide?
The molecular weight of 4'-Nitrobenzanilide is 242.07 g/mol.
Where can I buy 4'-Nitrobenzanilide?
You can request a quote for 4'-Nitrobenzanilide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4'-Nitrobenzanilide?
Yes, KEHONG BIO provides custom synthesis services for 4'-Nitrobenzanilide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.