N-(3-Fluorophenyl)-4-nitrobenzamide
TL;DR: N-(3-Fluorophenyl)-4-nitrobenzamide (CAS 167565-78-8) is a chemical compound with molecular formula C13H9FN2O3 and molecular weight 260.05972 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(3-fluorophenyl)-4-nitrobenzamide
Also Known As: N-(3-fluorophenyl)-4-nitrobenzamide, Hexanoic acid,2-bromo-,phenyl ester, Benzamide, N-(3-fluorophenyl)-4-nitro-, BIM-0011765.P001, N-(3-fluorophenyl)(4-nitrophenyl)carboxamide
Technical Specifications
| Molecular Formula | C13H9FN2O3 |
| Molecular Weight | 260.05972 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 74.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 260.05972 Da |
| Heavy Atoms | 19 |
| Complexity | 337.0 |
| SMILES | C1=CC(=CC(=C1)F)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | GVEHJKZKSVCWIT-UHFFFAOYSA-N |
Chemical Property Profile of N-(3-Fluorophenyl)-4-nitrobenzamide
Property Insights of N-(3-Fluorophenyl)-4-nitrobenzamide
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3-Fluorophenyl)-4-nitrobenzamide. The TPSA of 74.9 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3-Fluorophenyl)-4-nitrobenzamide. Following Lipinski's Rule of Five, N-(3-Fluorophenyl)-4-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
What is the CAS number of N-(3-Fluorophenyl)-4-nitrobenzamide?
The CAS number of N-(3-Fluorophenyl)-4-nitrobenzamide is 167565-78-8.
What is the molecular formula of N-(3-Fluorophenyl)-4-nitrobenzamide?
The molecular formula of N-(3-Fluorophenyl)-4-nitrobenzamide is C13H9FN2O3.
What is the molecular weight of N-(3-Fluorophenyl)-4-nitrobenzamide?
The molecular weight of N-(3-Fluorophenyl)-4-nitrobenzamide is 260.05972 g/mol.
Where can I buy N-(3-Fluorophenyl)-4-nitrobenzamide?
You can request a quote for N-(3-Fluorophenyl)-4-nitrobenzamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-(3-Fluorophenyl)-4-nitrobenzamide?
Yes, CoreyChem provides custom synthesis services for N-(3-Fluorophenyl)-4-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.