J092-0006 Screening compound: 3-{2-[5-(4-chlorophenyl)furan-2-yl]-2-oxoethyl}-3-hydroxy-7-methyl-2,3-dihydro-1H-indol-2-one

J092-0006 Screening compound: 3-{2-[5-(4-chlorophenyl)furan-2-yl]-2-oxoethyl}-3-hydroxy-7-methyl-2,3-dihydro-1H-indol-2-one
J092-0006 Screening compound: 3-{2-[5-(4-chlorophenyl)furan-2-yl]-2-oxoethyl}-3-hydroxy-7-methyl-2,3-dihydro-1H-indol-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound J092-0006
3-{2-[5-(4-chlorophenyl)furan-2-yl]-2-oxoethyl}-3-hydroxy-7-methyl-2,3-dihydro-1H-indol-2-one

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

J092-0006

Molecular Formula

C21H16ClNO4 (C21 H16 ClNO4)

Compound Name

3-{2-[5-(4-chlorophenyl)furan-2-yl]-2-oxoethyl}-3-hydroxy-7-methyl-2,3-dihydro-1H-indol-2-one

IUPAC name

3-{2-[5-(4-chlorophenyl)furan-2-yl]-2-oxoethyl}-3-hydroxy-7-methyl-23-dihydro-1H-indol-2-one

SMILES

Cc1cccc(C2(CC(c3ccc(-c(cc4)ccc4Cl)o3)=O)O)c1NC2=O

InChI

InChI=1S/C21H16ClNO4/c1-12-3-2-4-15-19(12)23-20(25)21(15,26)11-16(24)18-10-9-17(27-18)13-5-7-14(22)8-6-13/h2-10,26H,11H2,1H3,(H,23,25)/t21-/m0/s1

InChI Key

NMCITXQPJSPKFW-NRFANRHFSA-N

MDL Number (MFCD)

MFCD15080425

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

381.82

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.790

Distribution Coefficient, logD

3.790

Water Solubility, LogSw

-4.34

Polar Surface Area

59.965

Acid Dissociation Constant (pKa)

11.44

Base Dissociation Constant (pKb)

-2.23

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

14.30

J092-0006 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Antiviral Library (67538 compounds)

Immunological Library (6760 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with J092-0006 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J092-0006?
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What is the minimum amount of J092-0006 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J092-0006
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J092-0006
  • 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 J092-0006 available by request