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N-[2-(4-Methylphenoxy)ethyl]-2-nitrobenzamide
TL;DR: N-[2-(4-Methylphenoxy)ethyl]-2-nitrobenzamide (CAS 329063-79-8) is a chemical compound with molecular formula C16H16N2O4 and molecular weight 300.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(4-methylphenoxy)ethyl]-2-nitrobenzamide
Also Known As: N-[2-(4-Methylphenoxy)ethyl]-2-nitrobenzamide, N-(2-(4-Methylphenoxy)ethyl)-2-nitrobenzamide, N-[2-(4-Methylphenoxy)ethyl]-2-nitrobenzamide #, Benzamide, N-[2-(4-methylphenoxy)ethyl]-2-nitro-, N-[2-(4-methylphenoxy)ethyl](2-nitrophenyl)carboxamide
| Molecular Formula | C16H16N2O4 |
|---|---|
| Molecular Weight | 300.11 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 84.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 300.111 |
| Heavy Atoms | 22 |
| Complexity | 375.0 |
Chemical Identifiers
| CAS Number | 329063-79-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)OCCNC(=O)C2=CC=CC=C2[N+](=O)[O-] |
| InChIKey | LSWOOFZOQYSZRD-UHFFFAOYSA-N |
Product Overview
N-[2-(4-Methylphenoxy)ethyl]-2-nitrobenzamide (CAS 329063-79-8), with molecular formula C16H16N2O4 and molecular weight 300.11 g/mol. IUPAC: N-[2-(4-methylphenoxy)ethyl]-2-nitrobenzamide.
Chemical Property Profile of N-[2-(4-Methylphenoxy)ethyl]-2-nitrobenzamide
Property Insights of N-[2-(4-Methylphenoxy)ethyl]-2-nitrobenzamide
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[2-(4-Methylphenoxy)ethyl]-2-nitrobenzamide. The TPSA of 84.2 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[2-(4-Methylphenoxy)ethyl]-2-nitrobenzamide. Following Lipinski's Rule of Five, N-[2-(4-Methylphenoxy)ethyl]-2-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-[2-(4-Methylphenoxy)ethyl]-2-nitrobenzamide?
The CAS number of N-[2-(4-Methylphenoxy)ethyl]-2-nitrobenzamide is 329063-79-8.
What is the molecular formula of N-[2-(4-Methylphenoxy)ethyl]-2-nitrobenzamide?
The molecular formula of N-[2-(4-Methylphenoxy)ethyl]-2-nitrobenzamide is C16H16N2O4.
What is the molecular weight of N-[2-(4-Methylphenoxy)ethyl]-2-nitrobenzamide?
The molecular weight of N-[2-(4-Methylphenoxy)ethyl]-2-nitrobenzamide is 300.11 g/mol.
Where can I buy N-[2-(4-Methylphenoxy)ethyl]-2-nitrobenzamide?
You can request a quote for N-[2-(4-Methylphenoxy)ethyl]-2-nitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[2-(4-Methylphenoxy)ethyl]-2-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[2-(4-Methylphenoxy)ethyl]-2-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.