V016-5258 Screening compound: 3-{4-[(2-fluorophenyl)methoxy]phenyl}-5-(2-methoxyphenyl)-1,2,4-oxadiazole

V016-5258 Screening compound: 3-{4-[(2-fluorophenyl)methoxy]phenyl}-5-(2-methoxyphenyl)-1,2,4-oxadiazole
V016-5258 Screening compound: 3-{4-[(2-fluorophenyl)methoxy]phenyl}-5-(2-methoxyphenyl)-1,2,4-oxadiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound V016-5258
3-{4-[(2-fluorophenyl)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

V016-5258

Molecular Formula

C22H17FN2O3 (C22 H17 FN2 O3)

Compound Name

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

IUPAC name

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

SMILES

COc(cccc1)c1-c1nc(-c(cc2)ccc2OCc(cccc2)c2F)no1

InChI

InChI=1S/C22H17FN2O3/c1-26-20-9-5-3-7-18(20)22-24-21(25-28-22)15-10-12-17(13-11-15)27-14-16-6-2-4-8-19(16)23/h2-13H,14H2,1H3

InChI Key

CLAVZRLHNCIMRU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19900943

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

376.39

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

5.378

Distribution Coefficient, logD

5.378

Water Solubility, LogSw

-5.55

Polar Surface Area

46.502

Acid Dissociation Constant (pKa)

29.40

Base Dissociation Constant (pKb)

-5.76

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.10

V016-5258 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V016-5258 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V016-5258?
Check Price and Availability of V016-5258, 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 V016-5258 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V016-5258
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V016-5258
  • 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 V016-5258 available by request