5568-0392 Screening compound: (6Z)-6-[(2,5-dimethoxyphenyl)methylidene]-3-phenyl-5H,6H-[1,2,4]triazolo[3,4-b][1,3]thiazol-5-one

5568-0392 Screening compound: (6Z)-6-[(2,5-dimethoxyphenyl)methylidene]-3-phenyl-5H,6H-[1,2,4]triazolo[3,4-b][1,3]thiazol-5-one
5568-0392 Screening compound: (6Z)-6-[(2,5-dimethoxyphenyl)methylidene]-3-phenyl-5H,6H-[1,2,4]triazolo[3,4-b][1,3]thiazol-5-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 5568-0392
(6Z)-6-[(2,5-dimethoxyphenyl)methylidene]-3-phenyl-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

5568-0392

Molecular Formula

C19H15N3O3S (C19 H15 N3 O3 S)

Compound Name

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

IUPAC name

(6Z)-6-[(25-dimethoxyphenyl)methylidene]-3-phenyl-5H6H-[124]triazolo[34-b][13]thiazol-5-one

SMILES

COc(cc1)cc(/C=C2\Sc3nnc(-c4ccccc4)n3C2=O)c1OC

InChI

InChI=1S/C19H15N3O3S/c1-24-14-8-9-15(25-2)13(10-14)11-16-18(23)22-17(20-21-19(22)26-16)12-6-4-3-5-7-12/h3-11H,1-2H3

InChI Key

HLDAESHOBKUPAT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14710647

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

365.41

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.607

Distribution Coefficient, logD

3.607

Water Solubility, LogSw

-3.88

Polar Surface Area

53.119

Acid Dissociation Constant (pKa)

33.29

Base Dissociation Constant (pKb)

-2.22

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.50

References: we are preparing a list of scientific research reports with 5568-0392 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5568-0392?
Check Price and Availability of 5568-0392, 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 5568-0392 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5568-0392
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5568-0392
  • 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 5568-0392 available by request