Diphenyl(vinyl)sulfonium Triflate - CAS 247129-88-0
Catalog: |
BB018593 |
Product Name: |
Diphenyl(vinyl)sulfonium Triflate |
CAS: |
247129-88-0 |
Synonyms: |
ethenyl(diphenyl)sulfonium;trifluoromethanesulfonate; ethenyl(diphenyl)sulfanium;trifluoromethanesulfonate |
IUPAC Name: | ethenyl(diphenyl)sulfanium;trifluoromethanesulfonate |
Description: | Diphenylvinylsulfonium Triflate can be used as GLP-1r modulating compounds to treat GLP-1R mediated diseases such as metabolic and related diseases, including but not limited to NASH, obesity, and type 2 diabetes. |
Molecular Weight: | 362.39 |
Molecular Formula: | C15H13F3O3S2 |
Canonical SMILES: | C=C[S+](C1=CC=CC=C1)C2=CC=CC=C2.C(F)(F)(F)S(=O)(=O)[O-] |
InChI: | InChI=1S/C14H13S.CHF3O3S/c1-2-15(13-9-5-3-6-10-13)14-11-7-4-8-12-14;2-1(3,4)8(5,6)7/h2-12H,1H2;(H,5,6,7)/q+1;/p-1 |
InChI Key: | OKDGDBRZMJNKLV-UHFFFAOYSA-M |
MDL: | MFCD22123284 |
LogP: | 4.99860 |
Publication Number | Title | Priority Date |
WO-2021081207-A1 | Glp-1r modulating compounds | 20191025 |
US-2021171499-A1 | Glp-1r modulating compounds | 20191025 |
WO-2019177873-A1 | Arginase inhibitors and methods of use | 20180313 |
EP-3765006-A1 | Arginase inhibitors and methods of use | 20180313 |
AU-2018365793-A1 | Pyrrolopyrazine derivatives as alpha V integrin inhibitors | 20171107 |
Complexity: | 314 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 362.02582111 |
Formal Charge: | 0 |
Heavy Atom Count: | 23 |
Hydrogen Bond Acceptor Count: | 6 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 362.02582111 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 66.6 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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