[5-(tert-butylsulfamoyl)pyridin-3-yl]boronic acid - CAS 1314987-50-2
Catalog: |
BB007432 |
Product Name: |
[5-(tert-butylsulfamoyl)pyridin-3-yl]boronic acid |
CAS: |
1314987-50-2 |
Synonyms: |
[5-(tert-butylsulfamoyl)-3-pyridinyl]boronic acid; [5-(tert-butylsulfamoyl)pyridin-3-yl]boronic acid |
IUPAC Name: | [5-(tert-butylsulfamoyl)pyridin-3-yl]boronic acid |
Description: | [5-(tert-butylsulfamoyl)pyridin-3-yl]boronic acid (CAS# 1314987-50-2 ) is a useful research chemical. |
Molecular Weight: | 258.099 |
Molecular Formula: | C9H15BN2O4S |
Canonical SMILES: | B(C1=CC(=CN=C1)S(=O)(=O)NC(C)(C)C)(O)O |
InChI: | InChI=1S/C9H15BN2O4S/c1-9(2,3)12-17(15,16)8-4-7(10(13)14)5-11-6-8/h4-6,12-14H,1-3H3 |
InChI Key: | BHXPLHQBIOVPCK-UHFFFAOYSA-N |
LogP: | 0.30990 |
Publication Number | Title | Priority Date |
EP-2970296-A1 | Pyrrolotriazines as potassium ion channel inhibitors | 20130311 |
EP-2970296-B1 | Pyrrolotriazines as potassium ion channel inhibitors | 20130311 |
JP-2016512505-A | Pyrrolotriazines as potassium ion channel inhibitors | 20130311 |
JP-6427551-B2 | Pyrrolotriazine as a potassium ion channel inhibitor | 20130311 |
US-2014256719-A1 | Pyrrolotriazines as potassium ion channel inhibitors | 20130311 |
Complexity: | 347 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 258.0845583 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 6 |
Hydrogen Bond Donor Count: | 3 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 258.0845583 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 108 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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