N-(4-fluorobenzyl)-4-methoxy-3-nitrobenzamide
TL;DR: N-(4-fluorobenzyl)-4-methoxy-3-nitrobenzamide (CAS 690986-10-8) is a chemical compound with molecular formula C15H13FN2O4 and molecular weight 304.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(4-fluorophenyl)methyl]-4-methoxy-3-nitrobenzamide
Also Known As: N-(4-fluorobenzyl)-4-methoxy-3-nitrobenzamide, N-[(4-fluorophenyl)methyl]-4-methoxy-3-nitrobenzamide
| Molecular Formula | C15H13FN2O4 |
|---|---|
| Molecular Weight | 304.09 g/mol |
| LogP | 2.6725 |
| Topological Polar Surface Area | 81.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 304.08594 |
| Heavy Atoms | 22 |
| Complexity | 701.18866 |
Chemical Identifiers
| CAS Number | 690986-10-8 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C(=O)NCC2=CC=C(C=C2)F)[N+](=O)[O-] |
Product Overview
N-(4-fluorobenzyl)-4-methoxy-3-nitrobenzamide (CAS 690986-10-8), with molecular formula C15H13FN2O4 and molecular weight 304.09 g/mol. IUPAC: N-[(4-fluorophenyl)methyl]-4-methoxy-3-nitrobenzamide.
Chemical Property Profile of N-(4-fluorobenzyl)-4-methoxy-3-nitrobenzamide
Property Insights of N-(4-fluorobenzyl)-4-methoxy-3-nitrobenzamide
The XLogP value of 2.6725 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-fluorobenzyl)-4-methoxy-3-nitrobenzamide. The TPSA of 81.47 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-fluorobenzyl)-4-methoxy-3-nitrobenzamide. Following Lipinski's Rule of Five, N-(4-fluorobenzyl)-4-methoxy-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-fluorobenzyl)-4-methoxy-3-nitrobenzamide?
The CAS number of N-(4-fluorobenzyl)-4-methoxy-3-nitrobenzamide is 690986-10-8.
What is the molecular formula of N-(4-fluorobenzyl)-4-methoxy-3-nitrobenzamide?
The molecular formula of N-(4-fluorobenzyl)-4-methoxy-3-nitrobenzamide is C15H13FN2O4.
What is the molecular weight of N-(4-fluorobenzyl)-4-methoxy-3-nitrobenzamide?
The molecular weight of N-(4-fluorobenzyl)-4-methoxy-3-nitrobenzamide is 304.09 g/mol.
Where can I buy N-(4-fluorobenzyl)-4-methoxy-3-nitrobenzamide?
You can request a quote for N-(4-fluorobenzyl)-4-methoxy-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-fluorobenzyl)-4-methoxy-3-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-fluorobenzyl)-4-methoxy-3-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.