D619-0408 Screening compound: 2-{2-[5-(4-fluorophenyl)-1,2,4-oxadiazol-3-yl]phenoxy}-1-(pyrrolidin-1-yl)ethan-1-one

D619-0408 Screening compound: 2-{2-[5-(4-fluorophenyl)-1,2,4-oxadiazol-3-yl]phenoxy}-1-(pyrrolidin-1-yl)ethan-1-one
D619-0408 Screening compound: 2-{2-[5-(4-fluorophenyl)-1,2,4-oxadiazol-3-yl]phenoxy}-1-(pyrrolidin-1-yl)ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound D619-0408
2-{2-[5-(4-fluorophenyl)-1,2,4-oxadiazol-3-yl]phenoxy}-1-(pyrrolidin-1-yl)ethan-1-one

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

D619-0408

Molecular Formula

C20H18FN3O3 (C20 H18 FN3 O3)

Compound Name

2-{2-[5-(4-fluorophenyl)-1,2,4-oxadiazol-3-yl]phenoxy}-1-(pyrrolidin-1-yl)ethan-1-one

IUPAC name

2-{2-[5-(4-fluorophenyl)-124-oxadiazol-3-yl]phenoxy}-1-(pyrrolidin-1-yl)ethan-1-one

SMILES

O=C(COc(cccc1)c1-c1noc(-c(cc2)ccc2F)n1)N1CCCC1

InChI

InChI=1S/C20H18FN3O3/c21-15-9-7-14(8-10-15)20-22-19(23-27-20)16-5-1-2-6-17(16)26-13-18(25)24-11-3-4-12-24/h1-2,5-10H,3-4,11-13H2

InChI Key

UOESZXNIPODSSX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27594780

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

367.38

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.484

Distribution Coefficient, logD

3.484

Water Solubility, LogSw

-3.74

Polar Surface Area

55.717

Acid Dissociation Constant (pKa)

24.32

Base Dissociation Constant (pKb)

-1.27

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

D619-0408 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
Agro:
  • Agro

References: we are preparing a list of scientific research reports with D619-0408 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D619-0408?
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What is the minimum amount of D619-0408 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D619-0408
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D619-0408
  • 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 D619-0408 available by request