G794-1887 Screening compound: 3-(3-bromophenyl)-N-[4-(diethylamino)-2-methylphenyl]-5-methyl-1,2-oxazole-4-carboxamide

G794-1887 Screening compound: 3-(3-bromophenyl)-N-[4-(diethylamino)-2-methylphenyl]-5-methyl-1,2-oxazole-4-carboxamide
G794-1887 Screening compound: 3-(3-bromophenyl)-N-[4-(diethylamino)-2-methylphenyl]-5-methyl-1,2-oxazole-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G794-1887
3-(3-bromophenyl)-N-[4-(diethylamino)-2-methylphenyl]-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

G794-1887

Molecular Formula

C22H24BrN3O2 (C22 H24 BrN3 O2)

Compound Name

3-(3-bromophenyl)-N-[4-(diethylamino)-2-methylphenyl]-5-methyl-1,2-oxazole-4-carboxamide

IUPAC name

3-(3-bromophenyl)-N-[4-(diethylamino)-2-methylphenyl]-5-methyl-12-oxazole-4-carboxamide

SMILES

CCN(CC)c(cc1)cc(C)c1NC(c1c(C)onc1-c1cccc(Br)c1)=O

InChI

InChI=1S/C22H24BrN3O2/c1-5-26(6-2)18-10-11-19(14(3)12-18)24-22(27)20-15(4)28-25-21(20)16-8-7-9-17(23)13-16/h7-13H,5-6H2,1-4H3,(H,24,27)

InChI Key

WJZCKDMEFBKINR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27159470

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

442.36

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.322

Distribution Coefficient, logD

5.112

Water Solubility, LogSw

-5.40

Polar Surface Area

47.328

Acid Dissociation Constant (pKa)

11.59

Base Dissociation Constant (pKb)

9.85

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

G794-1887 in Drug Discovery

Included in Screening Libraries

Protein-Protein Interaction Library (218420 compounds)

Chemokine Receptor-Targeted Library (18382 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with G794-1887 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G794-1887?
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What is the minimum amount of G794-1887 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G794-1887
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G794-1887
  • 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 G794-1887 available by request