D321-1079 Screening compound: N-(3-chloro-4-fluorophenyl)-4-[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]butanamide

D321-1079 Screening compound: N-(3-chloro-4-fluorophenyl)-4-[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]butanamide
D321-1079 Screening compound: N-(3-chloro-4-fluorophenyl)-4-[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D321-1079
N-(3-chloro-4-fluorophenyl)-4-[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]butanamide

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

D321-1079

Molecular Formula

C17H14ClFN4O2 (C17 H14 ClFN4 O2)

Compound Name

N-(3-chloro-4-fluorophenyl)-4-[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]butanamide

IUPAC name

N-(3-chloro-4-fluorophenyl)-4-[3-(pyridin-3-yl)-124-oxadiazol-5-yl]butanamide

SMILES

O=C(CCCc1nc(-c2cnccc2)no1)Nc(cc1)cc(Cl)c1F

InChI

InChI=1S/C17H14ClFN4O2/c18-13-9-12(6-7-14(13)19)21-15(24)4-1-5-16-22-17(23-25-16)11-3-2-8-20-10-11/h2-3,6-10H,1,4-5H2,(H,21,24)

InChI Key

VFBLWAVAUQLOJH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14819150

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

360.78

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.070

Distribution Coefficient, logD

2.432

Water Solubility, LogSw

-3.57

Polar Surface Area

63.977

Acid Dissociation Constant (pKa)

8.85

Base Dissociation Constant (pKb)

7.93

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.60

D321-1079 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with D321-1079 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D321-1079?
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What is the minimum amount of D321-1079 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D321-1079
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D321-1079
  • 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 D321-1079 available by request