G944-0194 Screening compound: 4-[3-(1-ethyl-1H-1,2,3-benzotriazol-5-yl)-1,2,4-oxadiazol-5-yl]benzonitrile

G944-0194 Screening compound: 4-[3-(1-ethyl-1H-1,2,3-benzotriazol-5-yl)-1,2,4-oxadiazol-5-yl]benzonitrile
G944-0194 Screening compound: 4-[3-(1-ethyl-1H-1,2,3-benzotriazol-5-yl)-1,2,4-oxadiazol-5-yl]benzonitrile alternative view

Chemical Structure Depiction of ChemDiv screening compound G944-0194
4-[3-(1-ethyl-1H-1,2,3-benzotriazol-5-yl)-1,2,4-oxadiazol-5-yl]benzonitrile

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

G944-0194

Molecular Formula

C17H12N6O (C17 H12 N6 O)

Compound Name

4-[3-(1-ethyl-1H-1,2,3-benzotriazol-5-yl)-1,2,4-oxadiazol-5-yl]benzonitrile

IUPAC name

4-[3-(1-ethyl-1H-123-benzotriazol-5-yl)-124-oxadiazol-5-yl]benzonitrile

SMILES

CCn1nnc2c1ccc(-c1noc(-c(cc3)ccc3C#N)n1)c2

InChI

InChI=1S/C17H12N6O/c1-2-23-15-8-7-13(9-14(15)20-22-23)16-19-17(24-21-16)12-5-3-11(10-18)4-6-12/h3-9H,2H2,1H3

InChI Key

BTRVFUWHFIFKIG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27169187

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

316.32

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.180

Distribution Coefficient, logD

3.180

Water Solubility, LogSw

-3.16

Polar Surface Area

74.123

Acid Dissociation Constant (pKa)

26.27

Base Dissociation Constant (pKb)

0.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.80

G944-0194 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Antiparasite Library (23996 compounds)

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Infections
  • Immune system
  • animal
Mechanism of action:
  • Epigenetic
  • PPI modulators
Agro:
  • Agro

References: we are preparing a list of scientific research reports with G944-0194 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G944-0194?
Check Price and Availability of G944-0194, 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 G944-0194 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G944-0194
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G944-0194
  • 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 G944-0194 available by request