S940-0211 Screening compound: 1-(3-{[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]methyl}azetidin-1-yl)propan-1-one

S940-0211 Screening compound: 1-(3-{[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]methyl}azetidin-1-yl)propan-1-one
S940-0211 Screening compound: 1-(3-{[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]methyl}azetidin-1-yl)propan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound S940-0211
1-(3-{[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]methyl}azetidin-1-yl)propan-1-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

S940-0211

Molecular Formula

C14H16N4O2 (C14 H16 N4 O2)

Compound Name

1-(3-{[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]methyl}azetidin-1-yl)propan-1-one

IUPAC name

1-(3-{[3-(pyridin-3-yl)-124-oxadiazol-5-yl]methyl}azetidin-1-yl)propan-1-one

SMILES

CCC(N1CC(Cc2nc(-c3cnccc3)no2)C1)=O

InChI

InChI=1S/C14H16N4O2/c1-2-13(19)18-8-10(9-18)6-12-16-14(17-20-12)11-4-3-5-15-7-11/h3-5,7,10H,2,6,8-9H2,1H3

InChI Key

SYZQUNJKXLYUDE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD32000362

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

272.31

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

1.563

Distribution Coefficient, logD

0.925

Water Solubility, LogSw

-1.10

Polar Surface Area

57.418

Acid Dissociation Constant (pKa)

23.52

Base Dissociation Constant (pKb)

7.93

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.86

S940-0211 in Drug Discovery

Included in Screening Libraries

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with S940-0211 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S940-0211?
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What is the minimum amount of S940-0211 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S940-0211
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S940-0211
  • 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 S940-0211 available by request