1988-1606 Screening compound: N-{5-[(4-chlorophenyl)methyl]-1,3-thiazol-2-yl}-2-[(5Z)-5-[(2-chlorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetamide

1988-1606 Screening compound: N-{5-[(4-chlorophenyl)methyl]-1,3-thiazol-2-yl}-2-[(5Z)-5-[(2-chlorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetamide
1988-1606 Screening compound: N-{5-[(4-chlorophenyl)methyl]-1,3-thiazol-2-yl}-2-[(5Z)-5-[(2-chlorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1988-1606
N-{5-[(4-chlorophenyl)methyl]-1,3-thiazol-2-yl}-2-[(5Z)-5-[(2-chlorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetamide

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

1988-1606

Molecular Formula

C22H15Cl2N3O2S3 (C22 H15 Cl2 N3 O2 S3)

Compound Name

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

IUPAC name

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

SMILES

O=C(CN(C(/C(/S1)=C/c(cccc2)c2Cl)=O)C1=S)Nc1ncc(Cc(cc2)ccc2Cl)s1

InChI

InChI=1S/C22H15Cl2N3O2S3/c23-15-7-5-13(6-8-15)9-16-11-25-21(31-16)26-19(28)12-27-20(29)18(32-22(27)30)10-14-3-1-2-4-17(14)24/h1-8,10-11H,9,12H2,(H,25,26,28)

InChI Key

BTVDULSCJJCUDW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01164320

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

520.48

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.350

Distribution Coefficient, logD

6.350

Water Solubility, LogSw

-6.14

Polar Surface Area

49.888

Acid Dissociation Constant (pKa)

10.09

Base Dissociation Constant (pKb)

-0.68

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.10

References: we are preparing a list of scientific research reports with 1988-1606 chemical compound. It will be published here after verification.

Frequently Asked Questions

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What is the minimum amount of 1988-1606 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1988-1606
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1988-1606
  • 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 1988-1606 available by request