3241-0047 Screening compound: (5Z)-5-[(2-{2-[(4-methylphenyl)sulfanyl]ethoxy}phenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one

3241-0047 Screening compound: (5Z)-5-[(2-{2-[(4-methylphenyl)sulfanyl]ethoxy}phenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
3241-0047 Screening compound: (5Z)-5-[(2-{2-[(4-methylphenyl)sulfanyl]ethoxy}phenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 3241-0047
(5Z)-5-[(2-{2-[(4-methylphenyl)sulfanyl]ethoxy}phenyl)methylidene]-2-sulfanylidene-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

3241-0047

Molecular Formula

C19H17NO2S3 (C19 H17 NO2 S3)

Compound Name

(5Z)-5-[(2-{2-[(4-methylphenyl)sulfanyl]ethoxy}phenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one

IUPAC name

(5Z)-5-[(2-{2-[(4-methylphenyl)sulfanyl]ethoxy}phenyl)methylidene]-2-sulfanylidene-13-thiazolidin-4-one

SMILES

Cc(cc1)ccc1SCCOc1c(/C=C(/C(N2)=O)\SC2=S)cccc1

InChI

InChI=1S/C19H17NO2S3/c1-13-6-8-15(9-7-13)24-11-10-22-16-5-3-2-4-14(16)12-17-18(21)20-19(23)25-17/h2-9,12H,10-11H2,1H3,(H,20,21,23)

InChI Key

MCZZVSLQKGCYKK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02641828

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

387.55

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.401

Distribution Coefficient, logD

3.335

Water Solubility, LogSw

-4.36

Polar Surface Area

32.133

Acid Dissociation Constant (pKa)

6.37

Base Dissociation Constant (pKb)

-1.19

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.80

References: we are preparing a list of scientific research reports with 3241-0047 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3241-0047?
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What is the minimum amount of 3241-0047 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3241-0047
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3241-0047
  • 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 3241-0047 available by request