N-(4-ethoxyphenyl)-2-methyl-3-nitrobenzamide
TL;DR: N-(4-ethoxyphenyl)-2-methyl-3-nitrobenzamide (CAS 313981-36-1) 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-(4-ethoxyphenyl)-2-methyl-3-nitrobenzamide
Also Known As: N-(4-ethoxyphenyl)-2-methyl-3-nitrobenzamide, N-(4-ethoxyphenyl)-3-nitro-2-methylbenzamide, AB00081892-01, N-(4-ethoxyphenyl)(2-methyl-3-nitrophenyl)carboxamide
| Molecular Formula | C16H16N2O4 |
|---|---|
| Molecular Weight | 300.11 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 84.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 300.111 |
| Heavy Atoms | 22 |
| Complexity | 388.0 |
Chemical Identifiers
| CAS Number | 313981-36-1 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)NC(=O)C2=C(C(=CC=C2)[N+](=O)[O-])C |
| InChIKey | ZKMGGLMYUVPHEJ-UHFFFAOYSA-N |
Product Overview
N-(4-ethoxyphenyl)-2-methyl-3-nitrobenzamide (CAS 313981-36-1), with molecular formula C16H16N2O4 and molecular weight 300.11 g/mol. IUPAC: N-(4-ethoxyphenyl)-2-methyl-3-nitrobenzamide.
Chemical Property Profile of N-(4-ethoxyphenyl)-2-methyl-3-nitrobenzamide
Property Insights of N-(4-ethoxyphenyl)-2-methyl-3-nitrobenzamide
The XLogP value of 3.3 indicates that N-(4-ethoxyphenyl)-2-methyl-3-nitrobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.2 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-ethoxyphenyl)-2-methyl-3-nitrobenzamide. Following Lipinski's Rule of Five, N-(4-ethoxyphenyl)-2-methyl-3-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-(4-ethoxyphenyl)-2-methyl-3-nitrobenzamide?
The CAS number of N-(4-ethoxyphenyl)-2-methyl-3-nitrobenzamide is 313981-36-1.
What is the molecular formula of N-(4-ethoxyphenyl)-2-methyl-3-nitrobenzamide?
The molecular formula of N-(4-ethoxyphenyl)-2-methyl-3-nitrobenzamide is C16H16N2O4.
What is the molecular weight of N-(4-ethoxyphenyl)-2-methyl-3-nitrobenzamide?
The molecular weight of N-(4-ethoxyphenyl)-2-methyl-3-nitrobenzamide is 300.11 g/mol.
Where can I buy N-(4-ethoxyphenyl)-2-methyl-3-nitrobenzamide?
You can request a quote for N-(4-ethoxyphenyl)-2-methyl-3-nitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-ethoxyphenyl)-2-methyl-3-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-ethoxyphenyl)-2-methyl-3-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.