D327-0003 Screening compound: 3-{1-[2-(2-fluorophenyl)acetyl]piperidin-4-yl}-5-phenyl-2,3-dihydro-1,3,4-oxadiazol-2-one

D327-0003 Screening compound: 3-{1-[2-(2-fluorophenyl)acetyl]piperidin-4-yl}-5-phenyl-2,3-dihydro-1,3,4-oxadiazol-2-one
D327-0003 Screening compound: 3-{1-[2-(2-fluorophenyl)acetyl]piperidin-4-yl}-5-phenyl-2,3-dihydro-1,3,4-oxadiazol-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound D327-0003
3-{1-[2-(2-fluorophenyl)acetyl]piperidin-4-yl}-5-phenyl-2,3-dihydro-1,3,4-oxadiazol-2-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

D327-0003

Molecular Formula

C21H20FN3O3 (C21 H20 FN3 O3)

Compound Name

3-{1-[2-(2-fluorophenyl)acetyl]piperidin-4-yl}-5-phenyl-2,3-dihydro-1,3,4-oxadiazol-2-one

IUPAC name

3-{1-[2-(2-fluorophenyl)acetyl]piperidin-4-yl}-5-phenyl-23-dihydro-134-oxadiazol-2-one

SMILES

O=C(Cc(cccc1)c1F)N(CC1)CCC1N1N=C(c2ccccc2)OC1=O

InChI

InChI=1S/C21H20FN3O3/c22-18-9-5-4-8-16(18)14-19(26)24-12-10-17(11-13-24)25-21(27)28-20(23-25)15-6-2-1-3-7-15/h1-9,17H,10-14H2

InChI Key

GGYRPAOZNOBUSJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14819208

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

381.41

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.692

Distribution Coefficient, logD

3.692

Water Solubility, LogSw

-4.08

Polar Surface Area

50.724

Acid Dissociation Constant (pKa)

18.21

Base Dissociation Constant (pKb)

-1.16

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.60

D327-0003 in Drug Discovery

Included in Screening Libraries

Covalent Inhibitors Library (7986 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Structure:
  • Cyclic compounds
  • 3D
  • Fragments
Agro:
  • Agro

References: we are preparing a list of scientific research reports with D327-0003 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D327-0003?
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What is the minimum amount of D327-0003 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D327-0003
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D327-0003
  • 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 D327-0003 available by request