3-(4-fluorophenyl)aminocarbonylphenylboronic acid
Product Information
Molecular Formula
C13H11BFNO3
Molecular Weight
259.04
Description
3-(4-fluorophenyl)aminocarbonylphenylboronic acid can be used in the development of therapeutic drugs for cancer and neurological diseases. By selectively targeting specific enzymes or proteins, this product helps inhibit abnormal cell growth or activity associated with these conditions.
Synonyms
[3-[(4-fluorophenyl)carbamoyl]phenyl]boronic Acid; [3-(4-Fluorophenyl)aminocarbonylphenyl]boronic acid; {3-[(4-fluorophenyl)carbamoyl]phenyl}boronic acid; 3-[(4-Fluorophenyl)aminocarbonyl]benzeneboronic acid; 3-(4-fluorophenylcarbamoyl)phenylboronic acid; (3-((4-Fluorophenyl)carbamoyl)phenyl)boronicacid; 3-(4-fluorophenyl)aminocarbonyl-phenylboronic acid; 3-(4-fluorophenyl)aminocarbonylphenylboronic acid
IUPAC Name
[3-[(4-fluorophenyl)carbamoyl]phenyl]boronic acid
SMILES
B(C1=CC(=CC=C1)C(=O)NC2=CC=C(C=C2)F)(O)O
InChI
InChI=1S/C13H11BFNO3/c15-11-4-6-12(7-5-11)16-13(17)9-2-1-3-10(8-9)14(18)19/h1-8,18-19H,(H,16,17)
InChI Key
CKFWDDBBHPLQCY-UHFFFAOYSA-N
Flash Point
Not applicable
Computed Properties
Hydrogen Bond Donor Count
3
Hydrogen Bond Acceptor Count
4
Rotatable Bond Count
3
Exact Mass
259.0816015 g/mol
Monoisotopic Mass
259.0816015 g/mol
Topological Polar Surface Area
69.6Ų
Heavy Atom Count
19
Formal Charge
0
Complexity
308
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
Patents
| Publication Number | Title | Priority Date |
|---|---|---|
| AU-2011295441-A1 | Furopyridine derivatives | 2010-08-27 |
| AU-2011295441-B2 | Furopyridine derivatives | 2010-08-27 |
| CA-2809333-A1 | Furopyridine derivatives | 2010-08-27 |
| CA-2809333-C | Furopyridine derivatives | 2010-08-27 |
| EP-2609100-A2 | Furopyridine derivatives | 2010-08-27 |
| EP-2609100-B1 | Furopyridine derivatives | 2010-08-27 |
| KR-20130108318-A | Furopyridine Derivatives | 2010-08-27 |
| MX-2013002199-A | DERIVATIVES OF FUROPIRIDINE. | 2010-08-27 |
| US-2013225569-A1 | Furopyridine derivatives | 2010-08-27 |
| US-9006440-B2 | Furopyridine derivatives | 2010-08-27 |
