2-(azepan-1-yl)-N-(4-methoxyphenyl)-5-nitrobenzamide
TL;DR: 2-(azepan-1-yl)-N-(4-methoxyphenyl)-5-nitrobenzamide (CAS 361374-66-5) is a chemical compound with molecular formula C20H23N3O4 and molecular weight 369.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(azepan-1-yl)-N-(4-methoxyphenyl)-5-nitrobenzamide
Also Known As: 2-(azepan-1-yl)-N-(4-methoxyphenyl)-5-nitrobenzamide
| Molecular Formula | C20H23N3O4 |
|---|---|
| Molecular Weight | 369.17 g/mol |
| LogP | 4.2361 |
| Topological Polar Surface Area | 84.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 369.16885 |
| Heavy Atoms | 27 |
| Complexity | 812.47656 |
Chemical Identifiers
| CAS Number | 361374-66-5 |
|---|---|
| SMILES | COC1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCCCCC3 |
Product Overview
2-(azepan-1-yl)-N-(4-methoxyphenyl)-5-nitrobenzamide (CAS 361374-66-5), with molecular formula C20H23N3O4 and molecular weight 369.17 g/mol. IUPAC: 2-(azepan-1-yl)-N-(4-methoxyphenyl)-5-nitrobenzamide.
Chemical Property Profile of 2-(azepan-1-yl)-N-(4-methoxyphenyl)-5-nitrobenzamide
Property Insights of 2-(azepan-1-yl)-N-(4-methoxyphenyl)-5-nitrobenzamide
The XLogP value of 4.2361 indicates that 2-(azepan-1-yl)-N-(4-methoxyphenyl)-5-nitrobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.71 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(azepan-1-yl)-N-(4-methoxyphenyl)-5-nitrobenzamide. Following Lipinski's Rule of Five, 2-(azepan-1-yl)-N-(4-methoxyphenyl)-5-nitrobenzamide 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-(azepan-1-yl)-N-(4-methoxyphenyl)-5-nitrobenzamide?
The CAS number of 2-(azepan-1-yl)-N-(4-methoxyphenyl)-5-nitrobenzamide is 361374-66-5.
What is the molecular formula of 2-(azepan-1-yl)-N-(4-methoxyphenyl)-5-nitrobenzamide?
The molecular formula of 2-(azepan-1-yl)-N-(4-methoxyphenyl)-5-nitrobenzamide is C20H23N3O4.
What is the molecular weight of 2-(azepan-1-yl)-N-(4-methoxyphenyl)-5-nitrobenzamide?
The molecular weight of 2-(azepan-1-yl)-N-(4-methoxyphenyl)-5-nitrobenzamide is 369.17 g/mol.
Where can I buy 2-(azepan-1-yl)-N-(4-methoxyphenyl)-5-nitrobenzamide?
You can request a quote for 2-(azepan-1-yl)-N-(4-methoxyphenyl)-5-nitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(azepan-1-yl)-N-(4-methoxyphenyl)-5-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(azepan-1-yl)-N-(4-methoxyphenyl)-5-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.