N-(3-fluorophenyl)-4-methylbenzenesulfonamide
TL;DR: N-(3-fluorophenyl)-4-methylbenzenesulfonamide (CAS 13198-87-3) is a chemical compound with molecular formula C13H12FNO2S and molecular weight 265.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-fluorophenyl)-4-methylbenzenesulfonamide
Also Known As: N-(3-fluorophenyl)-4-methylbenzenesulfonamide, N-(3-fluorophenyl)-4-methylbenzene-1-sulfonamide, J2.887.957A, (3-fluorophenyl)[(4-methylphenyl)sulfonyl]amine, Cambridge id 5264802
| Molecular Formula | C13H12FNO2S |
|---|---|
| Molecular Weight | 265.06 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 54.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 265.05728 |
| Heavy Atoms | 18 |
| Complexity | 358.0 |
Chemical Identifiers
| CAS Number | 13198-87-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)NC2=CC(=CC=C2)F |
| InChIKey | RURQKBCIJLIYIW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-(3-fluorophenyl)-4-methylbenzenesulfonamide (CAS 13198-87-3), with molecular formula C13H12FNO2S and molecular weight 265.06 g/mol. IUPAC: N-(3-fluorophenyl)-4-methylbenzenesulfonamide.
Chemical Property Profile of N-(3-fluorophenyl)-4-methylbenzenesulfonamide
Property Insights of N-(3-fluorophenyl)-4-methylbenzenesulfonamide
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3-fluorophenyl)-4-methylbenzenesulfonamide. With a topological polar surface area (TPSA) of 54.6 Ų, N-(3-fluorophenyl)-4-methylbenzenesulfonamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3-fluorophenyl)-4-methylbenzenesulfonamide 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-(3-fluorophenyl)-4-methylbenzenesulfonamide?
The CAS number of N-(3-fluorophenyl)-4-methylbenzenesulfonamide is 13198-87-3.
What is the molecular formula of N-(3-fluorophenyl)-4-methylbenzenesulfonamide?
The molecular formula of N-(3-fluorophenyl)-4-methylbenzenesulfonamide is C13H12FNO2S.
What is the molecular weight of N-(3-fluorophenyl)-4-methylbenzenesulfonamide?
The molecular weight of N-(3-fluorophenyl)-4-methylbenzenesulfonamide is 265.06 g/mol.
Where can I buy N-(3-fluorophenyl)-4-methylbenzenesulfonamide?
You can request a quote for N-(3-fluorophenyl)-4-methylbenzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-fluorophenyl)-4-methylbenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3-fluorophenyl)-4-methylbenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.