Benzenesulfonothioic acid, 4-fluoro-, S-(2-(dimethylamino)ethyl) ester, N-oxide
TL;DR: Benzenesulfonothioic acid, 4-fluoro-, S-(2-(dimethylamino)ethyl) ester, N-oxide (CAS 139131-38-7) is a chemical compound with molecular formula C10H13FN2O4S2-2 and molecular weight 308.0301 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(4-fluorophenyl)sulfonylsulfanyl-1-N,1-N'-dimethyl-1-N,1-N'-dioxidoethane-1,1-diamine
Also Known As: Benzenesulfonothioic acid, 4-fluoro-, S-(2-(dimethylamino)ethyl) ester, N-oxide, 2-(4-fluorophenyl)sulfonylsulfanyl-1-N,1-N'-dimethyl-1-N,1-N'-dioxidoethane-1,1-diamine, 2-(4-fluorophenyl)sulfonylsulfanyl-N,N'-dimethyl-N,N'-dioxido-ethane-1,1-diamine, [{2-[(4-Fluorobenzene-1-sulfonyl)sulfanyl]ethane-1,1-diyl}bis(methylazanediyl)]bis(oxidanide)
Technical Specifications
| Molecular Formula | C10H13FN2O4S2-2 |
| Molecular Weight | 308.0301 g/mol |
| XLogP | 0.8 |
| Topological Polar Surface Area (TPSA) | 120.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 308.0301 Da |
| Heavy Atoms | 19 |
| Complexity | 360.0 |
| SMILES | CN(C(CSS(=O)(=O)C1=CC=C(C=C1)F)N(C)[O-])[O-] |
| InChIKey | GBMUXUITNOJRJY-UHFFFAOYSA-N |
Chemical Property Profile of Benzenesulfonothioic acid, 4-fluoro-, S-(2-(dimethylamino)ethyl) ester, N-oxide
Property Insights of Benzenesulfonothioic acid, 4-fluoro-, S-(2-(dimethylamino)ethyl) ester, N-oxide
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzenesulfonothioic acid, 4-fluoro-, S-(2-(dimethylamino)ethyl) ester, N-oxide. The TPSA of 120.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzenesulfonothioic acid, 4-fluoro-, S-(2-(dimethylamino)ethyl) ester, N-oxide. Following Lipinski's Rule of Five, Benzenesulfonothioic acid, 4-fluoro-, S-(2-(dimethylamino)ethyl) ester, N-oxide has 0 hydrogen bond donor(s) and 8 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-(dimethylamino)ethyl) ester, N-oxide?
The CAS number of Benzenesulfonothioic acid, 4-fluoro-, S-(2-(dimethylamino)ethyl) ester, N-oxide is 139131-38-7.
What is the molecular formula of Benzenesulfonothioic acid, 4-fluoro-, S-(2-(dimethylamino)ethyl) ester, N-oxide?
The molecular formula of Benzenesulfonothioic acid, 4-fluoro-, S-(2-(dimethylamino)ethyl) ester, N-oxide is C10H13FN2O4S2-2.
What is the molecular weight of Benzenesulfonothioic acid, 4-fluoro-, S-(2-(dimethylamino)ethyl) ester, N-oxide?
The molecular weight of Benzenesulfonothioic acid, 4-fluoro-, S-(2-(dimethylamino)ethyl) ester, N-oxide is 308.0301 g/mol.
Where can I buy Benzenesulfonothioic acid, 4-fluoro-, S-(2-(dimethylamino)ethyl) ester, N-oxide?
You can request a quote for Benzenesulfonothioic acid, 4-fluoro-, S-(2-(dimethylamino)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-(dimethylamino)ethyl) ester, N-oxide?
Yes, CoreyChem provides custom synthesis services for Benzenesulfonothioic acid, 4-fluoro-, S-(2-(dimethylamino)ethyl) ester, N-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.