V029-6786 Screening compound: 3-{4-[(2,6-difluorophenyl)methoxy]phenyl}-5-(4-fluorophenyl)-1,2,4-oxadiazole

V029-6786 Screening compound: 3-{4-[(2,6-difluorophenyl)methoxy]phenyl}-5-(4-fluorophenyl)-1,2,4-oxadiazole
V029-6786 Screening compound: 3-{4-[(2,6-difluorophenyl)methoxy]phenyl}-5-(4-fluorophenyl)-1,2,4-oxadiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound V029-6786
3-{4-[(2,6-difluorophenyl)methoxy]phenyl}-5-(4-fluorophenyl)-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

V029-6786

Molecular Formula

C21H13F3N2O2 (C21 H13 F3 N2 O2)

Compound Name

3-{4-[(2,6-difluorophenyl)methoxy]phenyl}-5-(4-fluorophenyl)-1,2,4-oxadiazole

IUPAC name

3-{4-[(26-difluorophenyl)methoxy]phenyl}-5-(4-fluorophenyl)-124-oxadiazole

SMILES

Fc(cc1)ccc1-c1nc(-c(cc2)ccc2OCc(c(F)ccc2)c2F)no1

InChI

InChI=1S/C21H13F3N2O2/c22-15-8-4-14(5-9-15)21-25-20(26-28-21)13-6-10-16(11-7-13)27-12-17-18(23)2-1-3-19(17)24/h1-11H,12H2

InChI Key

HLWOCMRMZKZXMQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19901035

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

382.34

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.719

Distribution Coefficient, logD

5.719

Water Solubility, LogSw

-6.09

Polar Surface Area

38.872

Acid Dissociation Constant (pKa)

29.40

Base Dissociation Constant (pKb)

-6.37

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.80

V029-6786 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with V029-6786 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V029-6786?
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What is the minimum amount of V029-6786 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V029-6786
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V029-6786
  • 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 V029-6786 available by request