1543-0196 Screening compound: (5E)-3-{[(3,4-dimethylphenyl)amino]methyl}-5-[(4-ethoxyphenyl)methylidene]-1,3-thiazolidine-2,4-dione

1543-0196 Screening compound: (5E)-3-{[(3,4-dimethylphenyl)amino]methyl}-5-[(4-ethoxyphenyl)methylidene]-1,3-thiazolidine-2,4-dione
1543-0196 Screening compound: (5E)-3-{[(3,4-dimethylphenyl)amino]methyl}-5-[(4-ethoxyphenyl)methylidene]-1,3-thiazolidine-2,4-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 1543-0196
(5E)-3-{[(3,4-dimethylphenyl)amino]methyl}-5-[(4-ethoxyphenyl)methylidene]-1,3-thiazolidine-2,4-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

1543-0196

Molecular Formula

C21H22N2O3S (C21 H22 N2 O3 S)

Compound Name

(5E)-3-{[(3,4-dimethylphenyl)amino]methyl}-5-[(4-ethoxyphenyl)methylidene]-1,3-thiazolidine-2,4-dione

IUPAC name

(5E)-3-{[(34-dimethylphenyl)amino]methyl}-5-[(4-ethoxyphenyl)methylidene]-13-thiazolidine-24-dione

SMILES

CCOc1ccc(/C=C(\C(N2CNc3cc(C)c(C)cc3)=O)/SC2=O)cc1

InChI

InChI=1S/C21H22N2O3S/c1-4-26-18-9-6-16(7-10-18)12-19-20(24)23(21(25)27-19)13-22-17-8-5-14(2)15(3)11-17/h5-12,22H,4,13H2,1-3H3

InChI Key

IFTAJKKOYUCIRF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00852913

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

382.48

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.347

Distribution Coefficient, logD

5.347

Water Solubility, LogSw

-5.27

Polar Surface Area

47.879

Acid Dissociation Constant (pKa)

19.34

Base Dissociation Constant (pKb)

3.01

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.80

References: we are preparing a list of scientific research reports with 1543-0196 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1543-0196?
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What is the minimum amount of 1543-0196 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1543-0196
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1543-0196
  • 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 1543-0196 available by request