N-(4-cyanophenyl)-3,5-dinitrobenzamide
TL;DR: N-(4-cyanophenyl)-3,5-dinitrobenzamide (CAS 36360-11-9) is a chemical compound with molecular formula C14H8N4O5 and molecular weight 312.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-cyanophenyl)-3,5-dinitrobenzamide
Also Known As: N-(4-cyanophenyl)-3,5-dinitrobenzamide, BAS 01219061, N-(4-Cyano-phenyl)-3,5-dinitro-benzamide, <4-Chlor-phenylsulfon>-essigsaeure-aethylester, (3,5-dinitrophenyl)-N-(4-cyanophenyl)carboxamide
| Molecular Formula | C14H8N4O5 |
|---|---|
| Molecular Weight | 312.05 g/mol |
| LogP | 2.62698 |
| Topological Polar Surface Area | 139.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 312.04947 |
| Heavy Atoms | 23 |
| Complexity | 806.9864 |
Chemical Identifiers
| CAS Number | 36360-11-9 |
|---|---|
| SMILES | C1=CC(=CC=C1C#N)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
N-(4-cyanophenyl)-3,5-dinitrobenzamide (CAS 36360-11-9), with molecular formula C14H8N4O5 and molecular weight 312.05 g/mol. IUPAC: N-(4-cyanophenyl)-3,5-dinitrobenzamide.
Chemical Property Profile of N-(4-cyanophenyl)-3,5-dinitrobenzamide
Property Insights of N-(4-cyanophenyl)-3,5-dinitrobenzamide
The XLogP value of 2.62698 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-cyanophenyl)-3,5-dinitrobenzamide. The TPSA of 139.17 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-cyanophenyl)-3,5-dinitrobenzamide. Following Lipinski's Rule of Five, N-(4-cyanophenyl)-3,5-dinitrobenzamide has 1 hydrogen bond donor(s) and 6 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)-3,5-dinitrobenzamide?
The CAS number of N-(4-cyanophenyl)-3,5-dinitrobenzamide is 36360-11-9.
What is the molecular formula of N-(4-cyanophenyl)-3,5-dinitrobenzamide?
The molecular formula of N-(4-cyanophenyl)-3,5-dinitrobenzamide is C14H8N4O5.
What is the molecular weight of N-(4-cyanophenyl)-3,5-dinitrobenzamide?
The molecular weight of N-(4-cyanophenyl)-3,5-dinitrobenzamide is 312.05 g/mol.
Where can I buy N-(4-cyanophenyl)-3,5-dinitrobenzamide?
You can request a quote for N-(4-cyanophenyl)-3,5-dinitrobenzamide 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)-3,5-dinitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-cyanophenyl)-3,5-dinitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.