1682-6903 Screening compound: (5E)-3-(2-chlorophenyl)-5-[(3,4-dimethoxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one

1682-6903 Screening compound: (5E)-3-(2-chlorophenyl)-5-[(3,4-dimethoxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
1682-6903 Screening compound: (5E)-3-(2-chlorophenyl)-5-[(3,4-dimethoxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 1682-6903
(5E)-3-(2-chlorophenyl)-5-[(3,4-dimethoxyphenyl)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

1682-6903

Molecular Formula

C18H14ClNO3S2 (C18 H14 ClNO3 S2)

Compound Name

(5E)-3-(2-chlorophenyl)-5-[(3,4-dimethoxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one

IUPAC name

(5E)-3-(2-chlorophenyl)-5-[(34-dimethoxyphenyl)methylidene]-2-sulfanylidene-13-thiazolidin-4-one

SMILES

COc(ccc(/C=C(\C(N1c(cccc2)c2Cl)=O)/SC1=S)c1)c1OC

InChI

InChI=1S/C18H14ClNO3S2/c1-22-14-8-7-11(9-15(14)23-2)10-16-17(21)20(18(24)25-16)13-6-4-3-5-12(13)19/h3-10H,1-2H3

InChI Key

BXIPHNWJDZGAKJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00523222

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

391.9

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.033

Distribution Coefficient, logD

4.033

Water Solubility, LogSw

-4.49

Polar Surface Area

30.791

Acid Dissociation Constant (pKa)

33.29

Base Dissociation Constant (pKb)

-1.34

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

References: we are preparing a list of scientific research reports with 1682-6903 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1682-6903?
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What is the minimum amount of 1682-6903 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1682-6903
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1682-6903
  • 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 1682-6903 available by request