![4-chloro-N-[2-[2-(4-methylphenoxy)ethylamino]-2-oxoethyl]-3-nitrobenzamide structure](/static/products/852/852840-01-8.png)
4-chloro-N-[2-[2-(4-methylphenoxy)ethylamino]-2-oxoethyl]-3-nitrobenzamide
TL;DR: 4-chloro-N-[2-[2-(4-methylphenoxy)ethylamino]-2-oxoethyl]-3-nitrobenzamide (CAS 852840-01-8) is a chemical compound with molecular formula C18H18ClN3O5 and molecular weight 391.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-N-[2-[2-(4-methylphenoxy)ethylamino]-2-oxoethyl]-3-nitrobenzamide
Also Known As: 4-chloro-N-[2-[2-(4-methylphenoxy)ethylamino]-2-oxoethyl]-3-nitrobenzamide, 4-Chloro-N-(2-{[2-(4-methylphenoxy)ethyl]amino}-2-oxoethyl)-3-nitrobenzamide
| Molecular Formula | C18H18ClN3O5 |
|---|---|
| Molecular Weight | 391.09 g/mol |
| LogP | 2.48162 |
| Topological Polar Surface Area | 110.57 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 391.0935 |
| Heavy Atoms | 27 |
| Complexity | 839.3908 |
Chemical Identifiers
| CAS Number | 852840-01-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)OCCNC(=O)CNC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-] |
Product Overview
4-chloro-N-[2-[2-(4-methylphenoxy)ethylamino]-2-oxoethyl]-3-nitrobenzamide (CAS 852840-01-8), with molecular formula C18H18ClN3O5 and molecular weight 391.09 g/mol. IUPAC: 4-chloro-N-[2-[2-(4-methylphenoxy)ethylamino]-2-oxoethyl]-3-nitrobenzamide.
Chemical Property Profile of 4-chloro-N-[2-[2-(4-methylphenoxy)ethylamino]-2-oxoethyl]-3-nitrobenzamide
Property Insights of 4-chloro-N-[2-[2-(4-methylphenoxy)ethylamino]-2-oxoethyl]-3-nitrobenzamide
The XLogP value of 2.48162 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-chloro-N-[2-[2-(4-methylphenoxy)ethylamino]-2-oxoethyl]-3-nitrobenzamide. The TPSA of 110.57 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-chloro-N-[2-[2-(4-methylphenoxy)ethylamino]-2-oxoethyl]-3-nitrobenzamide. Following Lipinski's Rule of Five, 4-chloro-N-[2-[2-(4-methylphenoxy)ethylamino]-2-oxoethyl]-3-nitrobenzamide has 2 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 4-chloro-N-[2-[2-(4-methylphenoxy)ethylamino]-2-oxoethyl]-3-nitrobenzamide?
The CAS number of 4-chloro-N-[2-[2-(4-methylphenoxy)ethylamino]-2-oxoethyl]-3-nitrobenzamide is 852840-01-8.
What is the molecular formula of 4-chloro-N-[2-[2-(4-methylphenoxy)ethylamino]-2-oxoethyl]-3-nitrobenzamide?
The molecular formula of 4-chloro-N-[2-[2-(4-methylphenoxy)ethylamino]-2-oxoethyl]-3-nitrobenzamide is C18H18ClN3O5.
What is the molecular weight of 4-chloro-N-[2-[2-(4-methylphenoxy)ethylamino]-2-oxoethyl]-3-nitrobenzamide?
The molecular weight of 4-chloro-N-[2-[2-(4-methylphenoxy)ethylamino]-2-oxoethyl]-3-nitrobenzamide is 391.09 g/mol.
Where can I buy 4-chloro-N-[2-[2-(4-methylphenoxy)ethylamino]-2-oxoethyl]-3-nitrobenzamide?
You can request a quote for 4-chloro-N-[2-[2-(4-methylphenoxy)ethylamino]-2-oxoethyl]-3-nitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-chloro-N-[2-[2-(4-methylphenoxy)ethylamino]-2-oxoethyl]-3-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-chloro-N-[2-[2-(4-methylphenoxy)ethylamino]-2-oxoethyl]-3-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.