8139-0290 Screening compound: 1-(4-fluorophenyl)-3-{[1-(thiophene-2-carbonyl)piperidin-4-yl]amino}pyrrolidine-2,5-dione

8139-0290 Screening compound: 1-(4-fluorophenyl)-3-{[1-(thiophene-2-carbonyl)piperidin-4-yl]amino}pyrrolidine-2,5-dione
8139-0290 Screening compound: 1-(4-fluorophenyl)-3-{[1-(thiophene-2-carbonyl)piperidin-4-yl]amino}pyrrolidine-2,5-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 8139-0290
1-(4-fluorophenyl)-3-{[1-(thiophene-2-carbonyl)piperidin-4-yl]amino}pyrrolidine-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

8139-0290

Molecular Formula

C20H20FN3O3S (C20 H20 FN3 O3 S)

Compound Name

1-(4-fluorophenyl)-3-{[1-(thiophene-2-carbonyl)piperidin-4-yl]amino}pyrrolidine-2,5-dione

IUPAC name

1-(4-fluorophenyl)-3-{[1-(thiophene-2-carbonyl)piperidin-4-yl]amino}pyrrolidine-25-dione

SMILES

O=C(c1cccs1)N(CC1)CCC1NC(CC(N1c(cc2)ccc2F)=O)C1=O

InChI

InChI=1S/C20H20FN3O3S/c21-13-3-5-15(6-4-13)24-18(25)12-16(19(24)26)22-14-7-9-23(10-8-14)20(27)17-2-1-11-28-17/h1-6,11,14,16,22H,7-10,12H2/t16-/m0/s1

InChI Key

PKDPXURIJYJLDS-INIZCTEOSA-N

MDL Number (MFCD)

MFCD06017097

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

401.46

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

1.484

Distribution Coefficient, logD

1.474

Water Solubility, LogSw

-2.35

Polar Surface Area

58.109

Acid Dissociation Constant (pKa)

17.24

Base Dissociation Constant (pKb)

5.77

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

35.00

8139-0290 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Anti-Inflammatory Library (24602 compounds)

Cysteine Proteases Inhibitors Library (7839 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Immune system
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Nervous system
  • Cardiovascular
  • Skin
  • Metabolic
  • Endocrine
  • Immune system
Mechanism of action:
  • Epigenetic
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with 8139-0290 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8139-0290?
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What is the minimum amount of 8139-0290 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8139-0290
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8139-0290
  • 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 8139-0290 available by request