S940-0130 Screening compound: 3-(5-{[1-(ethanesulfonyl)azetidin-3-yl]methyl}-1,2,4-oxadiazol-3-yl)pyridine

S940-0130 Screening compound: 3-(5-{[1-(ethanesulfonyl)azetidin-3-yl]methyl}-1,2,4-oxadiazol-3-yl)pyridine
S940-0130 Screening compound: 3-(5-{[1-(ethanesulfonyl)azetidin-3-yl]methyl}-1,2,4-oxadiazol-3-yl)pyridine alternative view

Chemical Structure Depiction of ChemDiv screening compound S940-0130
3-(5-{[1-(ethanesulfonyl)azetidin-3-yl]methyl}-1,2,4-oxadiazol-3-yl)pyridine

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

S940-0130

Molecular Formula

C13H16N4O3S (C13 H16 N4 O3 S)

Compound Name

3-(5-{[1-(ethanesulfonyl)azetidin-3-yl]methyl}-1,2,4-oxadiazol-3-yl)pyridine

IUPAC name

3-(5-{[1-(ethanesulfonyl)azetidin-3-yl]methyl}-124-oxadiazol-3-yl)pyridine

SMILES

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

InChI

InChI=1S/C13H16N4O3S/c1-2-21(18,19)17-8-10(9-17)6-12-15-13(16-20-12)11-4-3-5-14-7-11/h3-5,7,10H,2,6,8-9H2,1H3

InChI Key

RHGZYOSSYJLROY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD31999981

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

308.36

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.215

Distribution Coefficient, logD

0.576

Water Solubility, LogSw

-1.59

Polar Surface Area

72.902

Acid Dissociation Constant (pKa)

21.82

Base Dissociation Constant (pKb)

7.93

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

46.15

S940-0130 in Drug Discovery

Included in Screening Libraries

CNS MPO Library (28609 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with S940-0130 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S940-0130?
Check Price and Availability of S940-0130, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of S940-0130 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S940-0130
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S940-0130
  • 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 S940-0130 available by request