K786-0823 Screening compound: 2-{[(4-fluorophenyl)methyl]carbamoyl}benzoic acid

K786-0823 Screening compound: 2-{[(4-fluorophenyl)methyl]carbamoyl}benzoic acid
K786-0823 Screening compound: 2-{[(4-fluorophenyl)methyl]carbamoyl}benzoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound K786-0823
2-{[(4-fluorophenyl)methyl]carbamoyl}benzoic acid

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

K786-0823

Molecular Formula

C15H12FNO3 (C15 H12 FNO3)

Compound Name

2-{[(4-fluorophenyl)methyl]carbamoyl}benzoic acid

IUPAC name

2-{[(4-fluorophenyl)methyl]carbamoyl}benzoic acid

SMILES

OC(c(cccc1)c1C(NCc(cc1)ccc1F)=O)=O

InChI

InChI=1S/C15H12FNO3/c16-11-7-5-10(6-8-11)9-17-14(18)12-3-1-2-4-13(12)15(19)20/h1-8H,9H2,(H,17,18)(H,19,20)

InChI Key

XUHAISADKOVUOI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03830956

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

273.26

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.268

Distribution Coefficient, logD

-1.762

Water Solubility, LogSw

-2.60

Polar Surface Area

53.060

Acid Dissociation Constant (pKa)

3.37

Base Dissociation Constant (pKb)

-5.13

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

6.70

K786-0823 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Cardiovascular Library (22201 compounds)

KRAS-Targeted Library (16000 compounds)

Protein-Protein Interaction Library (218420 compounds)

Regenerative Medicine Focused Library (23016 compounds)

Antibacterial Compounds Library (13827 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cardiovascular
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds
  • Infections
  • Immune system
  • animal
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Agro:
  • Agro
Targets:
  • Kinases
  • Phosphatases
Mechanism of action:
  • PPI modulators
  • Epigenetic

References: we are preparing a list of scientific research reports with K786-0823 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K786-0823?
Check Price and Availability of K786-0823, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of K786-0823 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K786-0823
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K786-0823
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of K786-0823 available by request