8020-1266 Screening compound: 2-[3-(2,3-difluorophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-8-methoxyquinoline

8020-1266 Screening compound: 2-[3-(2,3-difluorophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-8-methoxyquinoline
8020-1266 Screening compound: 2-[3-(2,3-difluorophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-8-methoxyquinoline alternative view

Chemical Structure Depiction of ChemDiv screening compound 8020-1266
2-[3-(2,3-difluorophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-8-methoxyquinoline

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

8020-1266

Molecular Formula

C19H11F2N5OS (C19 H11 F2 N5 OS)

Compound Name

2-[3-(2,3-difluorophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-8-methoxyquinoline

IUPAC name

2-[3-(23-difluorophenyl)-[124]triazolo[34-b][134]thiadiazol-6-yl]-8-methoxyquinoline

SMILES

COc(cccc1cc2)c1nc2-c(s1)nn2c1nnc2-c(cccc1F)c1F

InChI

InChI=1S/C19H11F2N5OS/c1-27-14-7-2-4-10-8-9-13(22-16(10)14)18-25-26-17(23-24-19(26)28-18)11-5-3-6-12(20)15(11)21/h2-9H,1H3

InChI Key

RJVZXNWYFMFBLG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD12035091

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

395.39

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.199

Distribution Coefficient, logD

4.199

Water Solubility, LogSw

-4.61

Polar Surface Area

50.453

Acid Dissociation Constant (pKa)

32.55

Base Dissociation Constant (pKb)

0.22

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.30

8020-1266 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Anti-Inflammatory Library (24602 compounds)

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

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 8020-1266 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8020-1266?
Check Price and Availability of 8020-1266, 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 8020-1266 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8020-1266
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8020-1266
  • 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 8020-1266 available by request