D655-0416 Screening compound: 2-(2,3-dimethylphenoxy)-N-{4-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]phenyl}acetamide

D655-0416 Screening compound: 2-(2,3-dimethylphenoxy)-N-{4-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]phenyl}acetamide
D655-0416 Screening compound: 2-(2,3-dimethylphenoxy)-N-{4-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]phenyl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D655-0416
2-(2,3-dimethylphenoxy)-N-{4-[3-(4-fluorophenyl)-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

D655-0416

Molecular Formula

C24H20FN3O3 (C24 H20 FN3 O3)

Compound Name

2-(2,3-dimethylphenoxy)-N-{4-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]phenyl}acetamide

IUPAC name

2-(23-dimethylphenoxy)-N-{4-[3-(4-fluorophenyl)-124-oxadiazol-5-yl]phenyl}acetamide

SMILES

Cc1cccc(OCC(Nc(cc2)ccc2-c2nc(-c(cc3)ccc3F)no2)=O)c1C

InChI

InChI=1S/C24H20FN3O3/c1-15-4-3-5-21(16(15)2)30-14-22(29)26-20-12-8-18(9-13-20)24-27-23(28-31-24)17-6-10-19(25)11-7-17/h3-13H,14H2,1-2H3,(H,26,29)

InChI Key

JGXFQWMRJNMFLH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD18079220

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

417.44

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.984

Distribution Coefficient, logD

5.984

Water Solubility, LogSw

-5.62

Polar Surface Area

62.108

Acid Dissociation Constant (pKa)

13.10

Base Dissociation Constant (pKb)

-1.04

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

D655-0416 in Drug Discovery

Included in Screening Libraries

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

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 D655-0416 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D655-0416?
Check Price and Availability of D655-0416, 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 D655-0416 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D655-0416
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D655-0416
  • 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 D655-0416 available by request