200,000+ products from a single source!
sales@angenechem.com
Home > Imidazoles > 797812-92-1
797812-92-1 | 2-(2-Isopropyl-benzoimidazol-1-yl)-propionic acid
CAS No: 797812-92-1 Catalog No: AG01EXG0 MDL No:
Product Description
Catalog Number:
AG01EXG0
Chemical Name:
2-(2-Isopropyl-benzoimidazol-1-yl)-propionic acid
CAS Number:
797812-92-1
Molecular Formula:
C13H16N2O2
Molecular Weight:
232.2783
IUPAC Name:
2-(2-propan-2-ylbenzimidazol-1-yl)propanoic acid
InChI:
InChI=1S/C13H16N2O2/c1-8(2)12-14-10-6-4-5-7-11(10)15(12)9(3)13(16)17/h4-9H,1-3H3,(H,16,17)
InChI Key:
RJIDVTBWWMPEGE-UHFFFAOYSA-N
SMILES:
CC(n1c(nc2c1cccc2)C(C)C)C(=O)O
Properties
Complexity:
293
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.121g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
232.283g/mol
Monoisotopic Mass:
232.121g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
Literature
| Title | Journal |
|---|---|
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.