N-(2-Bromo-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-3-yl)pivalamide
Product Information
Molecular Formula
C16H24BBrN2O3
Molecular Weight
383.09
Description
N-(2-Bromo-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-3-yl)pivalamide is a highly potent compound widely employed in the field of biomedicine. Its profound influence lies in the realm of targeted therapies, revolutionizing the approach to combatting cancers and autoimmune disorders. Exhibiting remarkable chemical attributes, this exceptional compound harbors the ability to precisely target specific cells or receptors implicated in the intricate pathogenesis of diseases. By selectively inhibiting or modulating key pathways, it provides potential drug research ideas to improve patient outcomes.
Synonyms
N-[2-bromo-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-3-yl]-2,2-dimethylpropanamide; N-(2-Bromo-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-3-yl)pivalamide
IUPAC Name
N-[2-bromo-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-3-yl]-2,2-dimethylpropanamide
SMILES
B1(OC(C(O1)(C)C)(C)C)C2=CC(=C(N=C2)Br)NC(=O)C(C)(C)C
InChI
InChI=1S/C16H24BBrN2O3/c1-14(2,3)13(21)20-11-8-10(9-19-12(11)18)17-22-15(4,5)16(6,7)23-17/h8-9H,1-7H3,(H,20,21)
InChI Key
RWHMDEGUKHMIJX-UHFFFAOYSA-N
Flash Point
Not applicable
Safety Information
Hazards
H301
Precautionary Statement
P301 + P310
Computed Properties
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
4
Rotatable Bond Count
3
Exact Mass
382.10634 g/mol
Monoisotopic Mass
382.10634 g/mol
Topological Polar Surface Area
60.4Ų
Heavy Atom Count
23
Formal Charge
0
Complexity
449
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes
