G944-0714 Screening compound: N-{3-[3-(1-cyclopentyl-1H-1,2,3-benzotriazol-5-yl)-1,2,4-oxadiazol-5-yl]phenyl}acetamide

G944-0714 Screening compound: N-{3-[3-(1-cyclopentyl-1H-1,2,3-benzotriazol-5-yl)-1,2,4-oxadiazol-5-yl]phenyl}acetamide
G944-0714 Screening compound: N-{3-[3-(1-cyclopentyl-1H-1,2,3-benzotriazol-5-yl)-1,2,4-oxadiazol-5-yl]phenyl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G944-0714
N-{3-[3-(1-cyclopentyl-1H-1,2,3-benzotriazol-5-yl)-1,2,4-oxadiazol-5-yl]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

G944-0714

Molecular Formula

C21H20N6O2 (C21 H20 N6 O2)

Compound Name

N-{3-[3-(1-cyclopentyl-1H-1,2,3-benzotriazol-5-yl)-1,2,4-oxadiazol-5-yl]phenyl}acetamide

IUPAC name

N-{3-[3-(1-cyclopentyl-1H-123-benzotriazol-5-yl)-124-oxadiazol-5-yl]phenyl}acetamide

SMILES

CC(Nc1cc(-c2nc(-c(cc3)cc4c3n(C3CCCC3)nn4)no2)ccc1)=O

InChI

InChI=1S/C21H20N6O2/c1-13(28)22-16-6-4-5-15(11-16)21-23-20(25-29-21)14-9-10-19-18(12-14)24-26-27(19)17-7-2-3-8-17/h4-6,9-12,17H,2-3,7-8H2,1H3,(H,22,28)

InChI Key

IESLQDFZWWXSMZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27169343

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

388.43

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.016

Distribution Coefficient, logD

4.016

Water Solubility, LogSw

-4.14

Polar Surface Area

80.667

Acid Dissociation Constant (pKa)

13.54

Base Dissociation Constant (pKb)

0.27

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.60

G944-0714 in Drug Discovery

Included in Screening Libraries

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with G944-0714 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G944-0714?
Check Price and Availability of G944-0714, 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 G944-0714 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G944-0714
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G944-0714
  • 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 G944-0714 available by request