4659-0193 Screening compound: (6Z)-6-[(2,4-dichlorophenyl)methylidene]-3-(4-methylphenyl)-5H,6H-[1,2,4]triazolo[3,4-b][1,3]thiazol-5-one

4659-0193 Screening compound: (6Z)-6-[(2,4-dichlorophenyl)methylidene]-3-(4-methylphenyl)-5H,6H-[1,2,4]triazolo[3,4-b][1,3]thiazol-5-one
4659-0193 Screening compound: (6Z)-6-[(2,4-dichlorophenyl)methylidene]-3-(4-methylphenyl)-5H,6H-[1,2,4]triazolo[3,4-b][1,3]thiazol-5-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 4659-0193
(6Z)-6-[(2,4-dichlorophenyl)methylidene]-3-(4-methylphenyl)-5H,6H-[1,2,4]triazolo[3,4-b][1,3]thiazol-5-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

4659-0193

Molecular Formula

C18H11Cl2N3OS (C18 H11 Cl2 N3 OS)

Compound Name

(6Z)-6-[(2,4-dichlorophenyl)methylidene]-3-(4-methylphenyl)-5H,6H-[1,2,4]triazolo[3,4-b][1,3]thiazol-5-one

IUPAC name

(6Z)-6-[(24-dichlorophenyl)methylidene]-3-(4-methylphenyl)-5H6H-[124]triazolo[34-b][13]thiazol-5-one

SMILES

Cc(cc1)ccc1-c(n1C2=O)nnc1S/C2=C\c(ccc(Cl)c1)c1Cl

InChI

InChI=1S/C18H11Cl2N3OS/c1-10-2-4-11(5-3-10)16-21-22-18-23(16)17(24)15(25-18)8-12-6-7-13(19)9-14(12)20/h2-9H,1H3

InChI Key

SOOQSBWSAJUBME-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03009756

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

388.28

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.341

Distribution Coefficient, logD

5.341

Water Solubility, LogSw

-5.99

Polar Surface Area

37.944

Acid Dissociation Constant (pKa)

28.37

Base Dissociation Constant (pKb)

-2.52

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.60

4659-0193 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 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 4659-0193 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4659-0193?
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What is the minimum amount of 4659-0193 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4659-0193
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4659-0193
  • 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 4659-0193 available by request