8139-0292 Screening compound: 1-(4-propoxyphenyl)-3-{[1-(thiophene-2-carbonyl)piperidin-4-yl]amino}pyrrolidine-2,5-dione

8139-0292 Screening compound: 1-(4-propoxyphenyl)-3-{[1-(thiophene-2-carbonyl)piperidin-4-yl]amino}pyrrolidine-2,5-dione
8139-0292 Screening compound: 1-(4-propoxyphenyl)-3-{[1-(thiophene-2-carbonyl)piperidin-4-yl]amino}pyrrolidine-2,5-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 8139-0292
1-(4-propoxyphenyl)-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

8139-0292

Molecular Formula

C23H27N3O4S (C23 H27 N3 O4 S)

Compound Name

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

IUPAC name

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

SMILES

CCCOc(cc1)ccc1N(C(CC1NC(CC2)CCN2C(c2cccs2)=O)=O)C1=O

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

441.55

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.415

Distribution Coefficient, logD

2.404

Water Solubility, LogSw

-2.74

Polar Surface Area

65.527

Acid Dissociation Constant (pKa)

17.24

Base Dissociation Constant (pKb)

5.77

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

43.50

8139-0292 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Cysteine Proteases Inhibitors Library (7839 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 8139-0292 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8139-0292?
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What is the minimum amount of 8139-0292 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8139-0292
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8139-0292
  • 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 8139-0292 available by request