N-tert-butyl-4-fluoro-3-methylbenzenesulfonamide
TL;DR: N-tert-butyl-4-fluoro-3-methylbenzenesulfonamide (CAS 873588-98-8) is a chemical compound with molecular formula C11H16FNO2S and molecular weight 245.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-tert-butyl-4-fluoro-3-methylbenzenesulfonamide
Also Known As: N-tert-butyl-4-fluoro-3-methylbenzenesulfonamide, (tert-butyl)[(4-fluoro-3-methylphenyl)sulfonyl]amine, AP-263/43302258, N-(tert-butyl)-4-fluoro-3-methylbenzenesulfonamide
| Molecular Formula | C11H16FNO2S |
|---|---|
| Molecular Weight | 245.09 g/mol |
| LogP | 2.21092 |
| Topological Polar Surface Area | 46.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 245.08858 |
| Heavy Atoms | 16 |
| Complexity | 489.1963 |
Chemical Identifiers
| CAS Number | 873588-98-8 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)S(=O)(=O)NC(C)(C)C)F |
Product Overview
N-tert-butyl-4-fluoro-3-methylbenzenesulfonamide (CAS 873588-98-8), with molecular formula C11H16FNO2S and molecular weight 245.09 g/mol. IUPAC: N-tert-butyl-4-fluoro-3-methylbenzenesulfonamide.
Chemical Property Profile of N-tert-butyl-4-fluoro-3-methylbenzenesulfonamide
Property Insights of N-tert-butyl-4-fluoro-3-methylbenzenesulfonamide
The XLogP value of 2.21092 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-tert-butyl-4-fluoro-3-methylbenzenesulfonamide. With a topological polar surface area (TPSA) of 46.17 Ų, N-tert-butyl-4-fluoro-3-methylbenzenesulfonamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-tert-butyl-4-fluoro-3-methylbenzenesulfonamide has 1 hydrogen bond donor(s) and 2 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-tert-butyl-4-fluoro-3-methylbenzenesulfonamide?
The CAS number of N-tert-butyl-4-fluoro-3-methylbenzenesulfonamide is 873588-98-8.
What is the molecular formula of N-tert-butyl-4-fluoro-3-methylbenzenesulfonamide?
The molecular formula of N-tert-butyl-4-fluoro-3-methylbenzenesulfonamide is C11H16FNO2S.
What is the molecular weight of N-tert-butyl-4-fluoro-3-methylbenzenesulfonamide?
The molecular weight of N-tert-butyl-4-fluoro-3-methylbenzenesulfonamide is 245.09 g/mol.
Where can I buy N-tert-butyl-4-fluoro-3-methylbenzenesulfonamide?
You can request a quote for N-tert-butyl-4-fluoro-3-methylbenzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-tert-butyl-4-fluoro-3-methylbenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-tert-butyl-4-fluoro-3-methylbenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.