N-(4-cyanophenyl)-4-nitrobenzamide
TL;DR: N-(4-cyanophenyl)-4-nitrobenzamide (CAS 313552-72-6) is a chemical compound with molecular formula C14H9N3O3 and molecular weight 267.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-cyanophenyl)-4-nitrobenzamide
Also Known As: N-(4-cyanophenyl)-4-nitrobenzamide, N-(4-cyanophenyl)(4-nitrophenyl)carboxamide, J3.397.832D
| Molecular Formula | C14H9N3O3 |
|---|---|
| Molecular Weight | 267.06 g/mol |
| LogP | 2.71878 |
| Topological Polar Surface Area | 96.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 267.0644 |
| Heavy Atoms | 20 |
| Complexity | 685.09924 |
Chemical Identifiers
| CAS Number | 313552-72-6 |
|---|---|
| SMILES | C1=CC(=CC=C1C#N)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-] |
Product Overview
N-(4-cyanophenyl)-4-nitrobenzamide (CAS 313552-72-6), with molecular formula C14H9N3O3 and molecular weight 267.06 g/mol. IUPAC: N-(4-cyanophenyl)-4-nitrobenzamide.
Chemical Property Profile of N-(4-cyanophenyl)-4-nitrobenzamide
Property Insights of N-(4-cyanophenyl)-4-nitrobenzamide
The XLogP value of 2.71878 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-cyanophenyl)-4-nitrobenzamide. The TPSA of 96.03 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-cyanophenyl)-4-nitrobenzamide. Following Lipinski's Rule of Five, N-(4-cyanophenyl)-4-nitrobenzamide has 1 hydrogen bond donor(s) and 4 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-(4-cyanophenyl)-4-nitrobenzamide?
The CAS number of N-(4-cyanophenyl)-4-nitrobenzamide is 313552-72-6.
What is the molecular formula of N-(4-cyanophenyl)-4-nitrobenzamide?
The molecular formula of N-(4-cyanophenyl)-4-nitrobenzamide is C14H9N3O3.
What is the molecular weight of N-(4-cyanophenyl)-4-nitrobenzamide?
The molecular weight of N-(4-cyanophenyl)-4-nitrobenzamide is 267.06 g/mol.
Where can I buy N-(4-cyanophenyl)-4-nitrobenzamide?
You can request a quote for N-(4-cyanophenyl)-4-nitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-cyanophenyl)-4-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-cyanophenyl)-4-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.