N-(3-(4-fluorophenyl)-4-oxo-4H-chromen-2-yl)-4-nitrobenzamide
TL;DR: N-(3-(4-fluorophenyl)-4-oxo-4H-chromen-2-yl)-4-nitrobenzamide (CAS 879464-75-2) is a chemical compound with molecular formula C22H13FN2O5 and molecular weight 404.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-(4-fluorophenyl)-4-oxochromen-2-yl]-4-nitrobenzamide
Also Known As: AB01307606-01, N-[3-(4-fluorophenyl)-4-oxochromen-2-yl]-4-nitrobenzamide, N-(3-(4-fluorophenyl)-4-oxo-4H-chromen-2-yl)-4-nitrobenzamide, N-[3-(4-fluorophenyl)-4-oxo-4H-chromen-2-yl]-4-nitrobenzamide
| Molecular Formula | C22H13FN2O5 |
|---|---|
| Molecular Weight | 404.08 g/mol |
| LogP | 4.7596 |
| Topological Polar Surface Area | 102.45 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 404.08084 |
| Heavy Atoms | 30 |
| Complexity | 1328.7456 |
Chemical Identifiers
| CAS Number | 879464-75-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)C(=C(O2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=C(C=C4)F |
Product Overview
N-(3-(4-fluorophenyl)-4-oxo-4H-chromen-2-yl)-4-nitrobenzamide (CAS 879464-75-2), with molecular formula C22H13FN2O5 and molecular weight 404.08 g/mol. IUPAC: N-[3-(4-fluorophenyl)-4-oxochromen-2-yl]-4-nitrobenzamide.
Chemical Property Profile of N-(3-(4-fluorophenyl)-4-oxo-4H-chromen-2-yl)-4-nitrobenzamide
Property Insights of N-(3-(4-fluorophenyl)-4-oxo-4H-chromen-2-yl)-4-nitrobenzamide
The XLogP value of 4.7596 indicates that N-(3-(4-fluorophenyl)-4-oxo-4H-chromen-2-yl)-4-nitrobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.45 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3-(4-fluorophenyl)-4-oxo-4H-chromen-2-yl)-4-nitrobenzamide. Following Lipinski's Rule of Five, N-(3-(4-fluorophenyl)-4-oxo-4H-chromen-2-yl)-4-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 N-(3-(4-fluorophenyl)-4-oxo-4H-chromen-2-yl)-4-nitrobenzamide?
The CAS number of N-(3-(4-fluorophenyl)-4-oxo-4H-chromen-2-yl)-4-nitrobenzamide is 879464-75-2.
What is the molecular formula of N-(3-(4-fluorophenyl)-4-oxo-4H-chromen-2-yl)-4-nitrobenzamide?
The molecular formula of N-(3-(4-fluorophenyl)-4-oxo-4H-chromen-2-yl)-4-nitrobenzamide is C22H13FN2O5.
What is the molecular weight of N-(3-(4-fluorophenyl)-4-oxo-4H-chromen-2-yl)-4-nitrobenzamide?
The molecular weight of N-(3-(4-fluorophenyl)-4-oxo-4H-chromen-2-yl)-4-nitrobenzamide is 404.08 g/mol.
Where can I buy N-(3-(4-fluorophenyl)-4-oxo-4H-chromen-2-yl)-4-nitrobenzamide?
You can request a quote for N-(3-(4-fluorophenyl)-4-oxo-4H-chromen-2-yl)-4-nitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-(4-fluorophenyl)-4-oxo-4H-chromen-2-yl)-4-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3-(4-fluorophenyl)-4-oxo-4H-chromen-2-yl)-4-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.