1683-2286 Screening compound: N-{5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl}-4-[(5E)-5-[(4-fluorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanamide

1683-2286 Screening compound: N-{5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl}-4-[(5E)-5-[(4-fluorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanamide
1683-2286 Screening compound: N-{5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl}-4-[(5E)-5-[(4-fluorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1683-2286
N-{5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl}-4-[(5E)-5-[(4-fluorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]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

1683-2286

Molecular Formula

C24H19ClFN3O2S3 (C24 H19 ClFN3 O2 S3)

Compound Name

N-{5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl}-4-[(5E)-5-[(4-fluorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanamide

IUPAC name

N-{5-[(2-chlorophenyl)methyl]-13-thiazol-2-yl}-4-[(5E)-5-[(4-fluorophenyl)methylidene]-4-oxo-2-sulfanylidene-13-thiazolidin-3-yl]butanamide

SMILES

O=C(CCCN(C(/C(/S1)=C\c(cc2)ccc2F)=O)C1=S)Nc1ncc(Cc(cccc2)c2Cl)s1

InChI

InChI=1S/C24H19ClFN3O2S3/c25-19-5-2-1-4-16(19)13-18-14-27-23(33-18)28-21(30)6-3-11-29-22(31)20(34-24(29)32)12-15-7-9-17(26)10-8-15/h1-2,4-5,7-10,12,14H,3,6,11,13H2,(H,27,28,30)

InChI Key

WXKOZTOKYGAJOH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00707629

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

532.08

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.723

Distribution Coefficient, logD

5.721

Water Solubility, LogSw

-6.03

Polar Surface Area

49.867

Acid Dissociation Constant (pKa)

9.64

Base Dissociation Constant (pKb)

0.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

1683-2286 in Drug Discovery

Included in Screening Libraries

Frequent Hitters Library (7624 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with 1683-2286 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1683-2286?
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What is the minimum amount of 1683-2286 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1683-2286
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1683-2286
  • 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 1683-2286 available by request