G786-2171 Screening compound: 2-({2-phenylimidazo[1,2-b]pyridazin-6-yl}sulfanyl)-N-[2-(trifluoromethyl)phenyl]acetamide

G786-2171 Screening compound: 2-({2-phenylimidazo[1,2-b]pyridazin-6-yl}sulfanyl)-N-[2-(trifluoromethyl)phenyl]acetamide
G786-2171 Screening compound: 2-({2-phenylimidazo[1,2-b]pyridazin-6-yl}sulfanyl)-N-[2-(trifluoromethyl)phenyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G786-2171
2-({2-phenylimidazo[1,2-b]pyridazin-6-yl}sulfanyl)-N-[2-(trifluoromethyl)phenyl]acetamide

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

G786-2171

Molecular Formula

C21H15F3N4OS (C21 H15 F3 N4 OS)

Compound Name

2-({2-phenylimidazo[1,2-b]pyridazin-6-yl}sulfanyl)-N-[2-(trifluoromethyl)phenyl]acetamide

IUPAC name

2-({2-phenylimidazo[12-b]pyridazin-6-yl}sulfanyl)-N-[2-(trifluoromethyl)phenyl]acetamide

SMILES

O=C(CSc(cc1)nn2c1nc(-c1ccccc1)c2)Nc1c(C(F)(F)F)cccc1

InChI

InChI=1S/C21H15F3N4OS/c22-21(23,24)15-8-4-5-9-16(15)26-19(29)13-30-20-11-10-18-25-17(12-28(18)27-20)14-6-2-1-3-7-14/h1-12H,13H2,(H,26,29)

InChI Key

NATMIWMOFRMBNH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06733345

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

428.44

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.728

Distribution Coefficient, logD

4.727

Water Solubility, LogSw

-4.69

Polar Surface Area

41.203

Acid Dissociation Constant (pKa)

12.48

Base Dissociation Constant (pKb)

4.66

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.50

G786-2171 in Drug Discovery

Included in Screening Libraries

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

Protein-Protein Interaction Library (218420 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
Agro:
  • Agro

References: we are preparing a list of scientific research reports with G786-2171 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G786-2171?
Check Price and Availability of G786-2171, 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 G786-2171 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G786-2171
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G786-2171
  • 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 G786-2171 available by request