6163-4347 Screening compound: (6Z)-3-(4-chlorophenyl)-6-[(thiophen-2-yl)methylidene]-5H,6H-[1,2,4]triazolo[3,4-b][1,3]thiazol-5-one

6163-4347 Screening compound: (6Z)-3-(4-chlorophenyl)-6-[(thiophen-2-yl)methylidene]-5H,6H-[1,2,4]triazolo[3,4-b][1,3]thiazol-5-one
6163-4347 Screening compound: (6Z)-3-(4-chlorophenyl)-6-[(thiophen-2-yl)methylidene]-5H,6H-[1,2,4]triazolo[3,4-b][1,3]thiazol-5-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 6163-4347
(6Z)-3-(4-chlorophenyl)-6-[(thiophen-2-yl)methylidene]-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

6163-4347

Molecular Formula

C15H8ClN3OS2 (C15 H8 ClN3 OS2)

Compound Name

(6Z)-3-(4-chlorophenyl)-6-[(thiophen-2-yl)methylidene]-5H,6H-[1,2,4]triazolo[3,4-b][1,3]thiazol-5-one

IUPAC name

(6Z)-3-(4-chlorophenyl)-6-[(thiophen-2-yl)methylidene]-5H6H-[124]triazolo[34-b][13]thiazol-5-one

SMILES

O=C(/C(/S1)=C/c2cccs2)n2c1nnc2-c(cc1)ccc1Cl

InChI

InChI=1S/C15H8ClN3OS2/c16-10-5-3-9(4-6-10)13-17-18-15-19(13)14(20)12(22-15)8-11-2-1-7-21-11/h1-8H

InChI Key

HJTDPWQZXZECAT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04123954

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

345.83

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

3.750

Distribution Coefficient, logD

3.750

Water Solubility, LogSw

-4.44

Polar Surface Area

38.963

Acid Dissociation Constant (pKa)

14.00

Base Dissociation Constant (pKb)

-2.48

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

References: we are preparing a list of scientific research reports with 6163-4347 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6163-4347?
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What is the minimum amount of 6163-4347 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6163-4347
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6163-4347
  • 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 6163-4347 available by request