2-chloro-N-(2,6-diethylphenyl)-4-nitrobenzamide
TL;DR: 2-chloro-N-(2,6-diethylphenyl)-4-nitrobenzamide (CAS 449154-59-0) is a chemical compound with molecular formula C17H17ClN2O3 and molecular weight 332.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-N-(2,6-diethylphenyl)-4-nitrobenzamide
Also Known As: 2-chloro-N-(2,6-diethylphenyl)-4-nitrobenzamide, N-2,6-diethylphenyl2-chloro-4-nitrobenzamide, VU0509085-1, AB00305238-02, F3097-5834
| Molecular Formula | C17H17ClN2O3 |
|---|---|
| Molecular Weight | 332.09 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 74.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 332.09277 |
| Heavy Atoms | 23 |
| Complexity | 415.0 |
Chemical Identifiers
| CAS Number | 449154-59-0 |
|---|---|
| SMILES | CCC1=C(C(=CC=C1)CC)NC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl |
| InChIKey | IAWPUQABOMKFRR-UHFFFAOYSA-N |
Product Overview
2-chloro-N-(2,6-diethylphenyl)-4-nitrobenzamide (CAS 449154-59-0), with molecular formula C17H17ClN2O3 and molecular weight 332.09 g/mol. IUPAC: 2-chloro-N-(2,6-diethylphenyl)-4-nitrobenzamide.
Chemical Property Profile of 2-chloro-N-(2,6-diethylphenyl)-4-nitrobenzamide
Property Insights of 2-chloro-N-(2,6-diethylphenyl)-4-nitrobenzamide
The XLogP value of 4.8 indicates that 2-chloro-N-(2,6-diethylphenyl)-4-nitrobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-chloro-N-(2,6-diethylphenyl)-4-nitrobenzamide. Following Lipinski's Rule of Five, 2-chloro-N-(2,6-diethylphenyl)-4-nitrobenzamide 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 2-chloro-N-(2,6-diethylphenyl)-4-nitrobenzamide?
The CAS number of 2-chloro-N-(2,6-diethylphenyl)-4-nitrobenzamide is 449154-59-0.
What is the molecular formula of 2-chloro-N-(2,6-diethylphenyl)-4-nitrobenzamide?
The molecular formula of 2-chloro-N-(2,6-diethylphenyl)-4-nitrobenzamide is C17H17ClN2O3.
What is the molecular weight of 2-chloro-N-(2,6-diethylphenyl)-4-nitrobenzamide?
The molecular weight of 2-chloro-N-(2,6-diethylphenyl)-4-nitrobenzamide is 332.09 g/mol.
Where can I buy 2-chloro-N-(2,6-diethylphenyl)-4-nitrobenzamide?
You can request a quote for 2-chloro-N-(2,6-diethylphenyl)-4-nitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-chloro-N-(2,6-diethylphenyl)-4-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for 2-chloro-N-(2,6-diethylphenyl)-4-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.