E897-0529 Screening compound: N-(3-chlorophenyl)-2-[3'-(3,4-difluorophenyl)-2,4'-dioxo-1,2-dihydrospiro[indole-3,2'-[1,3]thiazolidin]-1-yl]acetamide

E897-0529 Screening compound: N-(3-chlorophenyl)-2-[3'-(3,4-difluorophenyl)-2,4'-dioxo-1,2-dihydrospiro[indole-3,2'-[1,3]thiazolidin]-1-yl]acetamide
E897-0529 Screening compound: N-(3-chlorophenyl)-2-[3'-(3,4-difluorophenyl)-2,4'-dioxo-1,2-dihydrospiro[indole-3,2'-[1,3]thiazolidin]-1-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E897-0529
N-(3-chlorophenyl)-2-[3'-(3,4-difluorophenyl)-2,4'-dioxo-1,2-dihydrospiro[indole-3,2'-[1,3]thiazolidin]-1-yl]acetamide

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

E897-0529

Molecular Formula

C24H16ClF2N3O3S (C24 H16 ClF2 N3 O3 S)

Compound Name

N-(3-chlorophenyl)-2-[3'-(3,4-difluorophenyl)-2,4'-dioxo-1,2-dihydrospiro[indole-3,2'-[1,3]thiazolidin]-1-yl]acetamide

IUPAC name

N-(3-chlorophenyl)-2-[3'-(34-difluorophenyl)-24'-dioxo-12-dihydrospiro[indole-32'-[13]thiazolidin]-1-yl]acetamide

SMILES

O=C(CN(C(C1(N2c(cc3)cc(F)c3F)SCC2=O)=O)c2c1cccc2)Nc1cccc(Cl)c1

InChI

InChI=1S/C24H16ClF2N3O3S/c25-14-4-3-5-15(10-14)28-21(31)12-29-20-7-2-1-6-17(20)24(23(29)33)30(22(32)13-34-24)16-8-9-18(26)19(27)11-16/h1-11H,12-13H2,(H,28,31)/t24-/m0/s1

InChI Key

FXQFTDQDHGRMSQ-DEOSSOPVSA-N

MDL Number (MFCD)

MFCD14926340

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

499.92

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.804

Distribution Coefficient, logD

4.804

Water Solubility, LogSw

-4.86

Polar Surface Area

54.185

Acid Dissociation Constant (pKa)

10.63

Base Dissociation Constant (pKb)

-0.43

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

12.50

E897-0529 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Anti-infective Library (19449 compounds)

Anticancer Library (62698 compounds)

Antiviral HBV Library (10007 compounds)

Protein-Protein Interaction Library (218420 compounds)

Selective Target Activity Profiling Library (14702 compounds)

Spiro Library (21655 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Cyclic compounds
  • Cyclic compounds
Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cancer
  • Antiviral
  • Infections
  • Immune system
Mechanism of action:
  • PPI modulators
  • PPI modulators

References: we are preparing a list of scientific research reports with E897-0529 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E897-0529?
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What is the minimum amount of E897-0529 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E897-0529
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E897-0529
  • 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 E897-0529 available by request