Benzenesulfonothioic acid, 4-fluoro-, S-(2-(bis(1-methylethyl)amino)ethyl) ester
TL;DR: Benzenesulfonothioic acid, 4-fluoro-, S-(2-(bis(1-methylethyl)amino)ethyl) ester (CAS 139131-31-0) is a chemical compound with molecular formula C14H22FNO2S2 and molecular weight 319.1076 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
Also Known As: Benzenesulfonothioic acid, 4-fluoro-, S-(2-(bis(1-methylethyl)amino)ethyl) ester, {2-[(4-fluorobenzenesulfonyl)sulfanyl]ethyl}bis(propan-2-yl)amine, S-{2-[Di(propan-2-yl)amino]ethyl} 4-fluorobenzene-1-sulfonothioate, 4-Fluorobenzenesulfonothioic acid S-[2-(diisopropylamino)ethyl] ester, N-[2-(4-fluorophenyl)sulfonylsulfanylethyl]-N-propan-2-yl-propan-2-amine
Technical Specifications
| Molecular Formula | C14H22FNO2S2 |
| Molecular Weight | 319.1076 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 71.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 319.1076 Da |
| Heavy Atoms | 20 |
| Complexity | 363.0 |
| SMILES | CC(C)N(CCSS(=O)(=O)C1=CC=C(C=C1)F)C(C)C |
| InChIKey | GMOPSAHTXBIMRF-UHFFFAOYSA-N |
Chemical Property Profile of Benzenesulfonothioic acid, 4-fluoro-, S-(2-(bis(1-methylethyl)amino)ethyl) ester
Property Insights of Benzenesulfonothioic acid, 4-fluoro-, S-(2-(bis(1-methylethyl)amino)ethyl) ester
The XLogP value of 3.3 indicates that Benzenesulfonothioic acid, 4-fluoro-, S-(2-(bis(1-methylethyl)amino)ethyl) ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzenesulfonothioic acid, 4-fluoro-, S-(2-(bis(1-methylethyl)amino)ethyl) ester. Following Lipinski's Rule of Five, Benzenesulfonothioic acid, 4-fluoro-, S-(2-(bis(1-methylethyl)amino)ethyl) ester 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?
The CAS number of Benzenesulfonothioic acid, 4-fluoro-, S-(2-(bis(1-methylethyl)amino)ethyl) ester is 139131-31-0.
What is the molecular formula of Benzenesulfonothioic acid, 4-fluoro-, S-(2-(bis(1-methylethyl)amino)ethyl) ester?
The molecular formula of Benzenesulfonothioic acid, 4-fluoro-, S-(2-(bis(1-methylethyl)amino)ethyl) ester is C14H22FNO2S2.
What is the molecular weight of Benzenesulfonothioic acid, 4-fluoro-, S-(2-(bis(1-methylethyl)amino)ethyl) ester?
The molecular weight of Benzenesulfonothioic acid, 4-fluoro-, S-(2-(bis(1-methylethyl)amino)ethyl) ester is 319.1076 g/mol.
Where can I buy Benzenesulfonothioic acid, 4-fluoro-, S-(2-(bis(1-methylethyl)amino)ethyl) ester?
You can request a quote for Benzenesulfonothioic acid, 4-fluoro-, S-(2-(bis(1-methylethyl)amino)ethyl) ester 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?
Yes, CoreyChem provides custom synthesis services for Benzenesulfonothioic acid, 4-fluoro-, S-(2-(bis(1-methylethyl)amino)ethyl) ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.