F082-0913 Screening compound: N-(4-bromo-3-methylphenyl)-3-(5-bromothiophen-2-yl)-5-methyl-1,2-oxazole-4-carboxamide

F082-0913 Screening compound: N-(4-bromo-3-methylphenyl)-3-(5-bromothiophen-2-yl)-5-methyl-1,2-oxazole-4-carboxamide
F082-0913 Screening compound: N-(4-bromo-3-methylphenyl)-3-(5-bromothiophen-2-yl)-5-methyl-1,2-oxazole-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F082-0913
N-(4-bromo-3-methylphenyl)-3-(5-bromothiophen-2-yl)-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

F082-0913

Molecular Formula

C16H12Br2N2O2S (C16 H12 Br2 N2 O2 S)

Compound Name

N-(4-bromo-3-methylphenyl)-3-(5-bromothiophen-2-yl)-5-methyl-1,2-oxazole-4-carboxamide

IUPAC name

N-(4-bromo-3-methylphenyl)-3-(5-bromothiophen-2-yl)-5-methyl-12-oxazole-4-carboxamide

SMILES

Cc1c(C(Nc(cc2)cc(C)c2Br)=O)c(-c(s2)ccc2Br)no1

InChI

InChI=1S/C16H12Br2N2O2S/c1-8-7-10(3-4-11(8)17)19-16(21)14-9(2)22-20-15(14)12-5-6-13(18)23-12/h3-7H,1-2H3,(H,19,21)

InChI Key

KMOJLGAUIPFDJF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27100269

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

456.16

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

5.394

Distribution Coefficient, logD

5.393

Water Solubility, LogSw

-5.52

Polar Surface Area

46.308

Acid Dissociation Constant (pKa)

10.21

Base Dissociation Constant (pKb)

-2.06

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

F082-0913 in Drug Discovery

Included in Screening Libraries

GABA Library (7115 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Eye
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Targets:
  • GPCR
  • Ion Channels
Mechanism of action:
  • Receptor's ligands
  • Epigenetic

References: we are preparing a list of scientific research reports with F082-0913 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F082-0913?
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What is the minimum amount of F082-0913 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F082-0913
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F082-0913
  • 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 F082-0913 available by request