D654-0421 Screening compound: 3-chloro-N-{2-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]phenyl}benzamide

D654-0421 Screening compound: 3-chloro-N-{2-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]phenyl}benzamide
D654-0421 Screening compound: 3-chloro-N-{2-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]phenyl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D654-0421
3-chloro-N-{2-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]phenyl}benzamide

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

D654-0421

Molecular Formula

C21H13ClFN3O2 (C21 H13 ClFN3 O2)

Compound Name

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

IUPAC name

3-chloro-N-{2-[3-(4-fluorophenyl)-124-oxadiazol-5-yl]phenyl}benzamide

SMILES

O=C(c1cccc(Cl)c1)Nc(cccc1)c1-c1nc(-c(cc2)ccc2F)no1

InChI

InChI=1S/C21H13ClFN3O2/c22-15-5-3-4-14(12-15)20(27)24-18-7-2-1-6-17(18)21-25-19(26-28-21)13-8-10-16(23)11-9-13/h1-12H,(H,24,27)

InChI Key

OHOVNEPAFASPGV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD18078938

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

393.8

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.654

Distribution Coefficient, logD

5.654

Water Solubility, LogSw

-5.90

Polar Surface Area

54.038

Acid Dissociation Constant (pKa)

10.59

Base Dissociation Constant (pKb)

-3.49

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

References: we are preparing a list of scientific research reports with D654-0421 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D654-0421?
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What is the minimum amount of D654-0421 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D654-0421
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D654-0421
  • 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 D654-0421 available by request