![N-[1-(4-Methoxyphenyl)ethyl]-3,5-dinitrobenzamide structure](/static/products/7492/74927-87-0.webp)
N-[1-(4-Methoxyphenyl)ethyl]-3,5-dinitrobenzamide
TL;DR: N-[1-(4-Methoxyphenyl)ethyl]-3,5-dinitrobenzamide (CAS 74927-87-0) is a chemical compound with molecular formula C16H15N3O6 and molecular weight 345.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[1-(4-methoxyphenyl)ethyl]-3,5-dinitrobenzamide
Also Known As: N-[1-(4-methoxyphenyl)ethyl]-3,5-dinitrobenzamide, J1.245.313B, N-(1-(4-Methoxyphenyl)ethyl)-3,5-dinitrobenzamide, N-[1-(4-Methoxy-phenyl)-ethyl]-3,5-dinitro-benzamide, (3,5-dinitrophenyl)-N-[(4-methoxyphenyl)ethyl]carboxamide
| Molecular Formula | C16H15N3O6 |
|---|---|
| Molecular Weight | 345.10 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 130.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 345.0961 |
| Heavy Atoms | 25 |
| Complexity | 473.0 |
Chemical Identifiers
| CAS Number | 74927-87-0 |
|---|---|
| SMILES | CC(C1=CC=C(C=C1)OC)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | FKKMNPYVEWUSBB-UHFFFAOYSA-N |
Product Overview
N-[1-(4-Methoxyphenyl)ethyl]-3,5-dinitrobenzamide (CAS 74927-87-0), with molecular formula C16H15N3O6 and molecular weight 345.10 g/mol. IUPAC: N-[1-(4-methoxyphenyl)ethyl]-3,5-dinitrobenzamide.
Chemical Property Profile of N-[1-(4-Methoxyphenyl)ethyl]-3,5-dinitrobenzamide
Property Insights of N-[1-(4-Methoxyphenyl)ethyl]-3,5-dinitrobenzamide
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[1-(4-Methoxyphenyl)ethyl]-3,5-dinitrobenzamide. The TPSA of 130.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[1-(4-Methoxyphenyl)ethyl]-3,5-dinitrobenzamide. Following Lipinski's Rule of Five, N-[1-(4-Methoxyphenyl)ethyl]-3,5-dinitrobenzamide has 1 hydrogen bond donor(s) and 6 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-[1-(4-Methoxyphenyl)ethyl]-3,5-dinitrobenzamide?
The CAS number of N-[1-(4-Methoxyphenyl)ethyl]-3,5-dinitrobenzamide is 74927-87-0.
What is the molecular formula of N-[1-(4-Methoxyphenyl)ethyl]-3,5-dinitrobenzamide?
The molecular formula of N-[1-(4-Methoxyphenyl)ethyl]-3,5-dinitrobenzamide is C16H15N3O6.
What is the molecular weight of N-[1-(4-Methoxyphenyl)ethyl]-3,5-dinitrobenzamide?
The molecular weight of N-[1-(4-Methoxyphenyl)ethyl]-3,5-dinitrobenzamide is 345.10 g/mol.
Where can I buy N-[1-(4-Methoxyphenyl)ethyl]-3,5-dinitrobenzamide?
You can request a quote for N-[1-(4-Methoxyphenyl)ethyl]-3,5-dinitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[1-(4-Methoxyphenyl)ethyl]-3,5-dinitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[1-(4-Methoxyphenyl)ethyl]-3,5-dinitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.