200,000+ products from a single source!
sales@angenechem.com
114627-27-9 | Boronic acid, B-[[(2,6-dimethoxybenzoyl)amino]methyl]-
CAS No: 114627-27-9 Catalog No: AG000EV3 MDL No:
Product Description
Catalog Number:
AG000EV3
Chemical Name:
Boronic acid, B-[[(2,6-dimethoxybenzoyl)amino]methyl]-
CAS Number:
114627-27-9
Molecular Formula:
C10H14BNO5
Molecular Weight:
239.0329
IUPAC Name:
[(2,6-dimethoxybenzoyl)amino]methylboronic acid
InChI:
InChI=1S/C10H14BNO5/c1-16-7-4-3-5-8(17-2)9(7)10(13)12-6-11(14)15/h3-5,14-15H,6H2,1-2H3,(H,12,13)
InChI Key:
SXURQNHWSSEFLG-UHFFFAOYSA-N
SMILES:
COc1cccc(c1C(=O)NCB(O)O)OC
Properties
Complexity:
239
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.097g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
239.034g/mol
Monoisotopic Mass:
239.097g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
88A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Literature
| Title | Journal |
|---|---|
| Synthesis and evaluation of boronic acids as inhibitors of Penicillin Binding Proteins of classes A, B and C. | Bioorganic & medicinal chemistry 20120615 |
| Unexpected tricovalent binding mode of boronic acids within the active site of a penicillin-binding protein. | Journal of the American Chemical Society 20110720 |
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.