6528-0290 Screening compound: 1-ethyl-3'-(3-fluoro-4-methylbenzoyl)-4'-hydroxy-1'-(2-methoxyethyl)-1,1',2,5'-tetrahydrospiro[indole-3,2'-pyrrole]-2,5'-dione

6528-0290 Screening compound: 1-ethyl-3'-(3-fluoro-4-methylbenzoyl)-4'-hydroxy-1'-(2-methoxyethyl)-1,1',2,5'-tetrahydrospiro[indole-3,2'-pyrrole]-2,5'-dione
6528-0290 Screening compound: 1-ethyl-3'-(3-fluoro-4-methylbenzoyl)-4'-hydroxy-1'-(2-methoxyethyl)-1,1',2,5'-tetrahydrospiro[indole-3,2'-pyrrole]-2,5'-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 6528-0290
1-ethyl-3'-(3-fluoro-4-methylbenzoyl)-4'-hydroxy-1'-(2-methoxyethyl)-1,1',2,5'-tetrahydrospiro[indole-3,2'-pyrrole]-2,5'-dione

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

6528-0290

Molecular Formula

C24H23FN2O5 (C24 H23 FN2 O5)

Compound Name

1-ethyl-3'-(3-fluoro-4-methylbenzoyl)-4'-hydroxy-1'-(2-methoxyethyl)-1,1',2,5'-tetrahydrospiro[indole-3,2'-pyrrole]-2,5'-dione

IUPAC name

1-ethyl-3'-(3-fluoro-4-methylbenzoyl)-4'-hydroxy-1'-(2-methoxyethyl)-11'25'-tetrahydrospiro[indole-32'-pyrrole]-25'-dione

SMILES

CCN(C(C1(C(C(c2cc(F)c(C)cc2)=O)=C2O)N(CCOC)C2=O)=O)c2c1cccc2

InChI

InChI=1S/C24H23FN2O5/c1-4-26-18-8-6-5-7-16(18)24(23(26)31)19(21(29)22(30)27(24)11-12-32-3)20(28)15-10-9-14(2)17(25)13-15/h5-10,13,29H,4,11-12H2,1-3H3/t24-/m0/s1

InChI Key

KVWLCEMIRPRADE-DEOSSOPVSA-N

MDL Number (MFCD)

MFCD06646041

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

438.46

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.109

Distribution Coefficient, logD

3.106

Water Solubility, LogSw

-3.43

Polar Surface Area

68.318

Acid Dissociation Constant (pKa)

9.57

Base Dissociation Constant (pKb)

-1.25

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

29.20

6528-0290 in Drug Discovery

Included in Screening Libraries

BRD4 Targeted Library (4534 compounds)

Protein-Protein Interaction Library (218420 compounds)

Spiro Library (21655 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Hemic and lymphatic
  • Cardiovascular
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds
  • Cyclic compounds

References: we are preparing a list of scientific research reports with 6528-0290 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6528-0290?
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What is the minimum amount of 6528-0290 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6528-0290
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6528-0290
  • 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 6528-0290 available by request