N-(4-fluorophenyl)-4-nitrobenzenesulfonamide
TL;DR: N-(4-fluorophenyl)-4-nitrobenzenesulfonamide (CAS 1545-96-6) is a chemical compound with molecular formula C12H9FN2O4S and molecular weight 296.0267 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(4-fluorophenyl)-4-nitrobenzenesulfonamide
Also Known As: N-(4-fluorophenyl)-4-nitrobenzenesulfonamide, 4'-fluoro-4-nitrobenzenesulfonanilide, N-(4-fluorophenyl)-4-nitrobenzene-1-sulfonamide, N-(4-Nitrophenylsulfonyl)-4-fluoroaniline, BB 0303974
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C12H9FN2O4S |
| Molecular Weight | 296.0267 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 100.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 296.0267 Da |
| Heavy Atoms | 20 |
| Complexity | 429.0 |
| SMILES | C1=CC(=CC=C1NS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])F |
| InChIKey | RKMMVQFCNBDFTL-UHFFFAOYSA-N |
Chemical Property Profile of N-(4-fluorophenyl)-4-nitrobenzenesulfonamide
Property Insights of N-(4-fluorophenyl)-4-nitrobenzenesulfonamide
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-fluorophenyl)-4-nitrobenzenesulfonamide. The TPSA of 100.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-fluorophenyl)-4-nitrobenzenesulfonamide. Following Lipinski's Rule of Five, N-(4-fluorophenyl)-4-nitrobenzenesulfonamide 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
What is the CAS number of N-(4-fluorophenyl)-4-nitrobenzenesulfonamide?
The CAS number of N-(4-fluorophenyl)-4-nitrobenzenesulfonamide is 1545-96-6.
What is the molecular formula of N-(4-fluorophenyl)-4-nitrobenzenesulfonamide?
The molecular formula of N-(4-fluorophenyl)-4-nitrobenzenesulfonamide is C12H9FN2O4S.
What is the molecular weight of N-(4-fluorophenyl)-4-nitrobenzenesulfonamide?
The molecular weight of N-(4-fluorophenyl)-4-nitrobenzenesulfonamide is 296.0267 g/mol.
Where can I buy N-(4-fluorophenyl)-4-nitrobenzenesulfonamide?
You can request a quote for N-(4-fluorophenyl)-4-nitrobenzenesulfonamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-(4-fluorophenyl)-4-nitrobenzenesulfonamide?
Yes, CoreyChem provides custom synthesis services for N-(4-fluorophenyl)-4-nitrobenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.