2',6'-Diethyl-3,5-dinitrobenzanilide
TL;DR: 2',6'-Diethyl-3,5-dinitrobenzanilide (CAS 38339-17-2) is a chemical compound with molecular formula C17H17N3O5 and molecular weight 343.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,6-diethylphenyl)-3,5-dinitrobenzamide
Also Known As: N-(2,6-diethylphenyl)-3,5-dinitrobenzamide, benzamide, n-(2,6-diethylphenyl)-3,5-dinitro-, 2',6'-DIETHYL-3,5-DINITROBENZANILIDE, J1.582.183C, N-(2,6-diethylphenyl)-3,5-dinitro-benzamide
| Molecular Formula | C17H17N3O5 |
|---|---|
| Molecular Weight | 343.12 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 121.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 343.11682 |
| Heavy Atoms | 25 |
| Complexity | 467.0 |
Chemical Identifiers
| CAS Number | 38339-17-2 |
|---|---|
| SMILES | CCC1=C(C(=CC=C1)CC)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | KLVKOTOSOWBSMY-UHFFFAOYSA-N |
Product Overview
2',6'-Diethyl-3,5-dinitrobenzanilide (CAS 38339-17-2), with molecular formula C17H17N3O5 and molecular weight 343.12 g/mol. IUPAC: N-(2,6-diethylphenyl)-3,5-dinitrobenzamide.
Chemical Property Profile of 2',6'-Diethyl-3,5-dinitrobenzanilide
Property Insights of 2',6'-Diethyl-3,5-dinitrobenzanilide
The XLogP value of 3.2 indicates that 2',6'-Diethyl-3,5-dinitrobenzanilide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 121.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2',6'-Diethyl-3,5-dinitrobenzanilide. Following Lipinski's Rule of Five, 2',6'-Diethyl-3,5-dinitrobenzanilide has 1 hydrogen bond donor(s) and 5 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',6'-Diethyl-3,5-dinitrobenzanilide?
The CAS number of 2',6'-Diethyl-3,5-dinitrobenzanilide is 38339-17-2.
What is the molecular formula of 2',6'-Diethyl-3,5-dinitrobenzanilide?
The molecular formula of 2',6'-Diethyl-3,5-dinitrobenzanilide is C17H17N3O5.
What is the molecular weight of 2',6'-Diethyl-3,5-dinitrobenzanilide?
The molecular weight of 2',6'-Diethyl-3,5-dinitrobenzanilide is 343.12 g/mol.
Where can I buy 2',6'-Diethyl-3,5-dinitrobenzanilide?
You can request a quote for 2',6'-Diethyl-3,5-dinitrobenzanilide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2',6'-Diethyl-3,5-dinitrobenzanilide?
Yes, KEHONG BIO provides custom synthesis services for 2',6'-Diethyl-3,5-dinitrobenzanilide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.