5720-0171 Screening compound: (5Z)-5-[(2-chlorophenyl)methylidene]-2-imino-3-(5-methyl-1,3,4-thiadiazol-2-yl)-1,3-thiazolidin-4-one

5720-0171 Screening compound: (5Z)-5-[(2-chlorophenyl)methylidene]-2-imino-3-(5-methyl-1,3,4-thiadiazol-2-yl)-1,3-thiazolidin-4-one
5720-0171 Screening compound: (5Z)-5-[(2-chlorophenyl)methylidene]-2-imino-3-(5-methyl-1,3,4-thiadiazol-2-yl)-1,3-thiazolidin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 5720-0171
(5Z)-5-[(2-chlorophenyl)methylidene]-2-imino-3-(5-methyl-1,3,4-thiadiazol-2-yl)-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

5720-0171

Molecular Formula

C13H9ClN4OS2 (C13 H9 ClN4 OS2)

Compound Name

(5Z)-5-[(2-chlorophenyl)methylidene]-2-imino-3-(5-methyl-1,3,4-thiadiazol-2-yl)-1,3-thiazolidin-4-one

IUPAC name

(5Z)-5-[(2-chlorophenyl)methylidene]-2-imino-3-(5-methyl-134-thiadiazol-2-yl)-13-thiazolidin-4-one

SMILES

Cc1nnc(N(C(/C(/S2)=C/c(cccc3)c3Cl)=O)C2=N)s1

InChI

InChI=1S/C13H9ClN4OS2/c1-7-16-17-13(20-7)18-11(19)10(21-12(18)15)6-8-4-2-3-5-9(8)14/h2-6,15H,1H3

InChI Key

VAALFGQZVOCUKL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03698407

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

336.83

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.657

Distribution Coefficient, logD

2.657

Water Solubility, LogSw

-3.43

Polar Surface Area

56.494

Acid Dissociation Constant (pKa)

30.70

Base Dissociation Constant (pKb)

3.47

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

7.70

5720-0171 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 5720-0171 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5720-0171?
Check Price and Availability of 5720-0171, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 5720-0171 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5720-0171
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5720-0171
  • 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 5720-0171 available by request