1-Isopropyl-6-oxo-1,6-dihydropyridine-3-boronic Acid Pinacol Ester - CAS 1349151-98-9
Catalog: |
BB008034 |
Product Name: |
1-Isopropyl-6-oxo-1,6-dihydropyridine-3-boronic Acid Pinacol Ester |
CAS: |
1349151-98-9 |
Synonyms: |
1-propan-2-yl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridinone; 1-propan-2-yl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-one |
IUPAC Name: | 1-propan-2-yl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-one |
Description: | 1-Isopropyl-6-oxo-1,6-dihydropyridine-3-boronic Acid Pinacol Ester (CAS# 1349151-98-9) is a useful research chemical. |
Molecular Weight: | 263.14 |
Molecular Formula: | C14H22NO3B |
Canonical SMILES: | B1(OC(C(O1)(C)C)(C)C)C2=CN(C(=O)C=C2)C(C)C |
InChI: | InChI=1S/C14H22BNO3/c1-10(2)16-9-11(7-8-12(16)17)15-18-13(3,4)14(5,6)19-15/h7-10H,1-6H3 |
InChI Key: | MPMZBWLBVFEODR-UHFFFAOYSA-N |
Storage: | Sealed in dry, 2-8 °C |
LogP: | 1.72840 |
Publication Number | Title | Priority Date |
WO-2020182666-A1 | Small molecule modulators of il-17 | 20190308 |
US-2020231589-A1 | 1,8-naphthyridinone compounds and uses thereof | 20190118 |
WO-2020150676-A1 | 1,8-naphthyridinone compounds and uses thereof | 20190118 |
US-2020223827-A1 | 3,3-difluoroallylamines or salts thereof and pharmaceutical compositions comprising the same | 20181214 |
TW-202039447-A | 3,3-difluoroallylamines or salts thereof and pharmaceutical compositions comprising the same | 20181214 |
Complexity: | 436 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 263.1692737 |
Formal Charge: | 0 |
Heavy Atom Count: | 19 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 263.1692737 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 38.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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