Benzenesulfonothioic acid, 4-fluoro-, S-(2-(bis(1-methylethyl)amino)ethyl) ester, N-oxide
TL;DR: Benzenesulfonothioic acid, 4-fluoro-, S-(2-(bis(1-methylethyl)amino)ethyl) ester, N-oxide (CAS 139131-39-8) is a chemical compound with molecular formula C14H22FNO3S2 and molecular weight 335.1025 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[2-(4-fluorophenyl)sulfonylsulfanylethyl]-N-propan-2-ylpropan-2-amine oxide
Also Known As: Benzenesulfonothioic acid, 4-fluoro-, S-(2-(bis(1-methylethyl)amino)ethyl) ester, N-oxide, N-[2-(4-fluorophenyl)sulfonylsulfanylethyl]-N-propan-2-yl-propan-2-amine Oxide, N-[2-(4-fluorophenyl)sulfonylsulfanylethyl]-N-propan-2-ylpropan-2-amine oxide, N-{2-[(4-Fluorobenzene-1-sulfonyl)sulfanyl]ethyl}-N-(propan-2-yl)propan-2-amine N-oxide
Technical Specifications
| Molecular Formula | C14H22FNO3S2 |
| Molecular Weight | 335.1025 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 85.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 335.1025 Da |
| Heavy Atoms | 21 |
| Complexity | 404.0 |
| SMILES | CC(C)[N+](CCSS(=O)(=O)C1=CC=C(C=C1)F)(C(C)C)[O-] |
| InChIKey | WCTUGNYXPHYIHG-UHFFFAOYSA-N |
Chemical Property Profile of Benzenesulfonothioic acid, 4-fluoro-, S-(2-(bis(1-methylethyl)amino)ethyl) ester, N-oxide
Property Insights of Benzenesulfonothioic acid, 4-fluoro-, S-(2-(bis(1-methylethyl)amino)ethyl) ester, N-oxide
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzenesulfonothioic acid, 4-fluoro-, S-(2-(bis(1-methylethyl)amino)ethyl) ester, N-oxide. The TPSA of 85.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzenesulfonothioic acid, 4-fluoro-, S-(2-(bis(1-methylethyl)amino)ethyl) ester, N-oxide. Following Lipinski's Rule of Five, Benzenesulfonothioic acid, 4-fluoro-, S-(2-(bis(1-methylethyl)amino)ethyl) ester, N-oxide has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Benzenesulfonothioic acid, 4-fluoro-, S-(2-(bis(1-methylethyl)amino)ethyl) ester, N-oxide?
The CAS number of Benzenesulfonothioic acid, 4-fluoro-, S-(2-(bis(1-methylethyl)amino)ethyl) ester, N-oxide is 139131-39-8.
What is the molecular formula of Benzenesulfonothioic acid, 4-fluoro-, S-(2-(bis(1-methylethyl)amino)ethyl) ester, N-oxide?
The molecular formula of Benzenesulfonothioic acid, 4-fluoro-, S-(2-(bis(1-methylethyl)amino)ethyl) ester, N-oxide is C14H22FNO3S2.
What is the molecular weight of Benzenesulfonothioic acid, 4-fluoro-, S-(2-(bis(1-methylethyl)amino)ethyl) ester, N-oxide?
The molecular weight of Benzenesulfonothioic acid, 4-fluoro-, S-(2-(bis(1-methylethyl)amino)ethyl) ester, N-oxide is 335.1025 g/mol.
Where can I buy Benzenesulfonothioic acid, 4-fluoro-, S-(2-(bis(1-methylethyl)amino)ethyl) ester, N-oxide?
You can request a quote for Benzenesulfonothioic acid, 4-fluoro-, S-(2-(bis(1-methylethyl)amino)ethyl) ester, N-oxide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Benzenesulfonothioic acid, 4-fluoro-, S-(2-(bis(1-methylethyl)amino)ethyl) ester, N-oxide?
Yes, CoreyChem provides custom synthesis services for Benzenesulfonothioic acid, 4-fluoro-, S-(2-(bis(1-methylethyl)amino)ethyl) ester, N-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.