G794-0789 Screening compound: N-(4-bromo-2-fluorophenyl)-3-(2,4-difluorophenyl)-5-methyl-1,2-oxazole-4-carboxamide

G794-0789 Screening compound: N-(4-bromo-2-fluorophenyl)-3-(2,4-difluorophenyl)-5-methyl-1,2-oxazole-4-carboxamide
G794-0789 Screening compound: N-(4-bromo-2-fluorophenyl)-3-(2,4-difluorophenyl)-5-methyl-1,2-oxazole-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G794-0789
N-(4-bromo-2-fluorophenyl)-3-(2,4-difluorophenyl)-5-methyl-1,2-oxazole-4-carboxamide

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

G794-0789

Molecular Formula

C17H10BrF3N2O2 (C17 H10 BrF3 N2 O2)

Compound Name

N-(4-bromo-2-fluorophenyl)-3-(2,4-difluorophenyl)-5-methyl-1,2-oxazole-4-carboxamide

IUPAC name

N-(4-bromo-2-fluorophenyl)-3-(24-difluorophenyl)-5-methyl-12-oxazole-4-carboxamide

SMILES

Cc1c(C(Nc(ccc(Br)c2)c2F)=O)c(-c(ccc(F)c2)c2F)no1

InChI

InChI=1S/C17H10BrF3N2O2/c1-8-15(17(24)22-14-5-2-9(18)6-13(14)21)16(23-25-8)11-4-3-10(19)7-12(11)20/h2-7H,1H3,(H,22,24)

InChI Key

MVRHZZWJUNTADP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27159313

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

411.18

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.596

Distribution Coefficient, logD

4.285

Water Solubility, LogSw

-4.51

Polar Surface Area

44.592

Acid Dissociation Constant (pKa)

7.38

Base Dissociation Constant (pKb)

-3.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.90

G794-0789 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Protein-Protein Interaction Library (218420 compounds)

Targeted Diversity Library (40567 compounds)

Chemokine Receptor-Targeted Library (18382 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Immune system
Mechanism of action:
  • PPI modulators
  • Receptor's ligands

References: we are preparing a list of scientific research reports with G794-0789 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G794-0789?
Check Price and Availability of G794-0789, 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 G794-0789 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G794-0789
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G794-0789
  • 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 G794-0789 available by request