6-(Methylsulfonylmethyl)pyridine-3-boronic Acid Pinacol Ester - CAS 1421341-29-8
Catalog: |
BB009304 |
Product Name: |
6-(Methylsulfonylmethyl)pyridine-3-boronic Acid Pinacol Ester |
CAS: |
1421341-29-8 |
Synonyms: |
2-(methylsulfonylmethyl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine; 2-(methylsulfonylmethyl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine |
IUPAC Name: | 2-(methylsulfonylmethyl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine |
Description: | 6-(Methylsulfonylmethyl)pyridine-3-boronic Acid Pinacol Ester (CAS# 1421341-29-8 ) is a useful research chemical. |
Molecular Weight: | 297.18 |
Molecular Formula: | C13H20NO4SB |
Canonical SMILES: | B1(OC(C(O1)(C)C)(C)C)C2=CN=C(C=C2)CS(=O)(=O)C |
InChI: | InChI=1S/C13H20BNO4S/c1-12(2)13(3,4)19-14(18-12)10-6-7-11(15-8-10)9-20(5,16)17/h6-8H,9H2,1-5H3 |
InChI Key: | PXEQIPHWJUJVRZ-UHFFFAOYSA-N |
Publication Number | Title | Priority Date |
US-2015368228-A1 | Antiviral compounds | 20130305 |
US-2017081312-A1 | Antiviral compounds | 20130305 |
US-9540345-B2 | Antiviral compounds | 20130305 |
EA-024845-B1 | Substituted quinolines and their use as medicaments | 20110726 |
EP-2736886-B1 | Substituted quinolines and their use as medicaments | 20110726 |
Complexity: | 442 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 297.1206095 |
Formal Charge: | 0 |
Heavy Atom Count: | 20 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 297.1206095 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 73.9 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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