G952-0592 Screening compound: N-[3-(3-fluorophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-2,2-dimethylpropanamide

G952-0592 Screening compound: N-[3-(3-fluorophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-2,2-dimethylpropanamide
G952-0592 Screening compound: N-[3-(3-fluorophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-2,2-dimethylpropanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G952-0592
N-[3-(3-fluorophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-2,2-dimethylpropanamide

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

G952-0592

Molecular Formula

C14H14FN5OS (C14 H14 FN5 OS)

Compound Name

N-[3-(3-fluorophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-2,2-dimethylpropanamide

IUPAC name

N-[3-(3-fluorophenyl)-[124]triazolo[34-b][134]thiadiazol-6-yl]-22-dimethylpropanamide

SMILES

CC(C)(C)C(Nc(s1)nn2c1nnc2-c1cc(F)ccc1)=O

InChI

InChI=1S/C14H14FN5OS/c1-14(2,3)11(21)16-12-19-20-10(17-18-13(20)22-12)8-5-4-6-9(15)7-8/h4-7H,1-3H3,(H,16,19,21)

InChI Key

XOFVMSOFFJEMOS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27170174

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

319.36

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.015

Distribution Coefficient, logD

3.012

Water Solubility, LogSw

-3.45

Polar Surface Area

57.397

Acid Dissociation Constant (pKa)

9.58

Base Dissociation Constant (pKb)

0.56

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.60

G952-0592 in Drug Discovery

Included in Screening Libraries

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with G952-0592 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G952-0592?
Check Price and Availability of G952-0592, 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 G952-0592 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G952-0592
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G952-0592
  • 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 G952-0592 available by request