F040-0014 Screening compound: 1-(4-methylpiperidin-1-yl)-2-[(3-phenyl-1,2,4-oxadiazol-5-yl)sulfanyl]ethan-1-one

F040-0014 Screening compound: 1-(4-methylpiperidin-1-yl)-2-[(3-phenyl-1,2,4-oxadiazol-5-yl)sulfanyl]ethan-1-one
F040-0014 Screening compound: 1-(4-methylpiperidin-1-yl)-2-[(3-phenyl-1,2,4-oxadiazol-5-yl)sulfanyl]ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound F040-0014
1-(4-methylpiperidin-1-yl)-2-[(3-phenyl-1,2,4-oxadiazol-5-yl)sulfanyl]ethan-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

F040-0014

Molecular Formula

C16H19N3O2S (C16 H19 N3 O2 S)

Compound Name

1-(4-methylpiperidin-1-yl)-2-[(3-phenyl-1,2,4-oxadiazol-5-yl)sulfanyl]ethan-1-one

IUPAC name

1-(4-methylpiperidin-1-yl)-2-[(3-phenyl-124-oxadiazol-5-yl)sulfanyl]ethan-1-one

SMILES

CC(CC1)CCN1C(CSc1nc(-c2ccccc2)no1)=O

InChI

InChI=1S/C16H19N3O2S/c1-12-7-9-19(10-8-12)14(20)11-22-16-17-15(18-21-16)13-5-3-2-4-6-13/h2-6,12H,7-11H2,1H3

InChI Key

NASKQGOPZZZUBX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14938050

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

317.41

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.436

Distribution Coefficient, logD

3.436

Water Solubility, LogSw

-3.59

Polar Surface Area

47.618

Acid Dissociation Constant (pKa)

20.50

Base Dissociation Constant (pKb)

5.47

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

43.80

F040-0014 in Drug Discovery

Included in Screening Libraries

Soluble Diversity Library (15920 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with F040-0014 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F040-0014?
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What is the minimum amount of F040-0014 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F040-0014
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F040-0014
  • 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 F040-0014 available by request