8008-8938 Screening compound: (5E)-5-({2-[(4-chlorophenyl)sulfanyl]phenyl}methylidene)-2-imino-1,3-thiazolidin-4-one

8008-8938 Screening compound: (5E)-5-({2-[(4-chlorophenyl)sulfanyl]phenyl}methylidene)-2-imino-1,3-thiazolidin-4-one
8008-8938 Screening compound: (5E)-5-({2-[(4-chlorophenyl)sulfanyl]phenyl}methylidene)-2-imino-1,3-thiazolidin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 8008-8938
(5E)-5-({2-[(4-chlorophenyl)sulfanyl]phenyl}methylidene)-2-imino-1,3-thiazolidin-4-one

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

8008-8938

Molecular Formula

C16H11ClN2OS2 (C16 H11 ClN2 OS2)

Compound Name

(5E)-5-({2-[(4-chlorophenyl)sulfanyl]phenyl}methylidene)-2-imino-1,3-thiazolidin-4-one

IUPAC name

(5E)-5-({2-[(4-chlorophenyl)sulfanyl]phenyl}methylidene)-2-imino-13-thiazolidin-4-one

SMILES

N=C(NC1=O)S/C1=C/c(cccc1)c1Sc(cc1)ccc1Cl

InChI

InChI=1S/C16H11ClN2OS2/c17-11-5-7-12(8-6-11)21-13-4-2-1-3-10(13)9-14-15(20)19-16(18)22-14/h1-9H,(H2,18,19,20)

InChI Key

IKLHNYHUKUXLBK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01207269

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

346.86

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.018

Distribution Coefficient, logD

4.017

Water Solubility, LogSw

-4.52

Polar Surface Area

42.242

Acid Dissociation Constant (pKa)

9.98

Base Dissociation Constant (pKb)

2.77

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

8008-8938 in Drug Discovery

Included in Screening Libraries

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

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 8008-8938 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8008-8938?
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What is the minimum amount of 8008-8938 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8008-8938
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8008-8938
  • 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 8008-8938 available by request