K292-2001 Screening compound: 4-{4-oxo-2-[(2-oxo-2-phenylethyl)sulfanyl]-3H,4H-thieno[3,2-d]pyrimidin-3-yl}-N-[2-(4-sulfamoylphenyl)ethyl]butanamide

K292-2001 Screening compound: 4-{4-oxo-2-[(2-oxo-2-phenylethyl)sulfanyl]-3H,4H-thieno[3,2-d]pyrimidin-3-yl}-N-[2-(4-sulfamoylphenyl)ethyl]butanamide
K292-2001 Screening compound: 4-{4-oxo-2-[(2-oxo-2-phenylethyl)sulfanyl]-3H,4H-thieno[3,2-d]pyrimidin-3-yl}-N-[2-(4-sulfamoylphenyl)ethyl]butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K292-2001
4-{4-oxo-2-[(2-oxo-2-phenylethyl)sulfanyl]-3H,4H-thieno[3,2-d]pyrimidin-3-yl}-N-[2-(4-sulfamoylphenyl)ethyl]butanamide

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

K292-2001

Molecular Formula

C26H26N4O5S3 (C26 H26 N4 O5 S3)

Compound Name

4-{4-oxo-2-[(2-oxo-2-phenylethyl)sulfanyl]-3H,4H-thieno[3,2-d]pyrimidin-3-yl}-N-[2-(4-sulfamoylphenyl)ethyl]butanamide

IUPAC name

4-{4-oxo-2-[(2-oxo-2-phenylethyl)sulfanyl]-3H4H-thieno[32-d]pyrimidin-3-yl}-N-[2-(4-sulfamoylphenyl)ethyl]butanamide

SMILES

NS(c1ccc(CCNC(CCCN(C2=O)C(SCC(c3ccccc3)=O)=Nc3c2scc3)=O)cc1)(=O)=O

InChI

InChI=1S/C26H26N4O5S3/c27-38(34,35)20-10-8-18(9-11-20)12-14-28-23(32)7-4-15-30-25(33)24-21(13-16-36-24)29-26(30)37-17-22(31)19-5-2-1-3-6-19/h1-3,5-6,8-11,13,16H,4,7,12,14-15,17H2,(H,28,32)(H2,27,34,35)

InChI Key

YQFMUOSBEBRMPT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15092163

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

570.71

Hydrogen Bond Acceptors Count

13.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.434

Distribution Coefficient, logD

1.433

Water Solubility, LogSw

-2.28

Polar Surface Area

114.931

Acid Dissociation Constant (pKa)

10.18

Base Dissociation Constant (pKb)

0.72

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.10

K292-2001 in Drug Discovery

Included in Screening Libraries

ACE2 Library (3043 compounds)

CORONAVIRUS Library (20774 compounds)

Eccentric PPI Library (11937 compounds)

Protein-Protein Interaction Library (218420 compounds)

Regenerative Medicine Focused Library (23016 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with K292-2001 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K292-2001?
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What is the minimum amount of K292-2001 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K292-2001
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K292-2001
  • 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 K292-2001 available by request