V009-5691 Screening compound: 3-{4-[(3,4-difluorophenyl)methoxy]phenyl}-5-(2-methoxyphenyl)-1,2,4-oxadiazole

V009-5691 Screening compound: 3-{4-[(3,4-difluorophenyl)methoxy]phenyl}-5-(2-methoxyphenyl)-1,2,4-oxadiazole
V009-5691 Screening compound: 3-{4-[(3,4-difluorophenyl)methoxy]phenyl}-5-(2-methoxyphenyl)-1,2,4-oxadiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound V009-5691
3-{4-[(3,4-difluorophenyl)methoxy]phenyl}-5-(2-methoxyphenyl)-1,2,4-oxadiazole

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

V009-5691

Molecular Formula

C22H16F2N2O3 (C22 H16 F2 N2 O3)

Compound Name

3-{4-[(3,4-difluorophenyl)methoxy]phenyl}-5-(2-methoxyphenyl)-1,2,4-oxadiazole

IUPAC name

3-{4-[(34-difluorophenyl)methoxy]phenyl}-5-(2-methoxyphenyl)-124-oxadiazole

SMILES

COc(cccc1)c1-c1nc(-c(cc2)ccc2OCc(cc2)cc(F)c2F)no1

InChI

InChI=1S/C22H16F2N2O3/c1-27-20-5-3-2-4-17(20)22-25-21(26-29-22)15-7-9-16(10-8-15)28-13-14-6-11-18(23)19(24)12-14/h2-12H,13H2,1H3

InChI Key

IEFFLDLDLAWNLO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19901061

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

394.38

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.579

Distribution Coefficient, logD

5.579

Water Solubility, LogSw

-5.61

Polar Surface Area

46.502

Acid Dissociation Constant (pKa)

28.55

Base Dissociation Constant (pKb)

-5.76

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.10

V009-5691 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with V009-5691 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V009-5691?
Check Price and Availability of V009-5691, 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 V009-5691 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V009-5691
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V009-5691
  • 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 V009-5691 available by request