S211-0893 Screening compound: (3-cyclopropyl-1,2,4-oxadiazol-5-yl)methyl {1-[(4-methyl-1,3-thiazol-5-yl)methyl]-4-piperidyl} ether

S211-0893 Screening compound: (3-cyclopropyl-1,2,4-oxadiazol-5-yl)methyl {1-[(4-methyl-1,3-thiazol-5-yl)methyl]-4-piperidyl} ether
S211-0893 Screening compound: (3-cyclopropyl-1,2,4-oxadiazol-5-yl)methyl {1-[(4-methyl-1,3-thiazol-5-yl)methyl]-4-piperidyl} ether alternative view

Chemical Structure Depiction of ChemDiv screening compound S211-0893
(3-cyclopropyl-1,2,4-oxadiazol-5-yl)methyl {1-[(4-methyl-1,3-thiazol-5-yl)methyl]-4-piperidyl} ether

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

S211-0893

Molecular Formula

C16H22N4O2S (C16 H22 N4 O2 S)

Compound Name

(3-cyclopropyl-1,2,4-oxadiazol-5-yl)methyl {1-[(4-methyl-1,3-thiazol-5-yl)methyl]-4-piperidyl} ether

IUPAC name

4-[(3-cyclopropyl-124-oxadiazol-5-yl)methoxy]-1-[(4-methyl-13-thiazol-5-yl)methyl]piperidine

SMILES

Cc1c(CN(CC2)CCC2OCc2nc(C3CC3)no2)scn1

InChI

InChI=1S/C16H22N4O2S/c1-11-14(23-10-17-11)8-20-6-4-13(5-7-20)21-9-15-18-16(19-22-15)12-2-3-12/h10,12-13H,2-9H2,1H3

InChI Key

MAGOODNHLWYAMS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29033599

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

334.44

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.188

Distribution Coefficient, logD

1.028

Water Solubility, LogSw

-2.02

Polar Surface Area

52.784

Acid Dissociation Constant (pKa)

24.36

Base Dissociation Constant (pKb)

8.53

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

68.75

S211-0893 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

GPCR Targeted Library (31838 compounds)

PPI Helix Turn 3D-Mimetics Library (71298 compounds)

Protein-Protein Interaction Library (218420 compounds)

Akt-Targeted Library (14764 compounds)

Alpha-Helix Mimetics Library (25899 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • GPCR
  • Kinases
Mechanism of action:
  • Receptor's ligands
  • PPI modulators
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Mimetics
  • Cyclic compounds

References: we are preparing a list of scientific research reports with S211-0893 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S211-0893?
Check Price and Availability of S211-0893, 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 S211-0893 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S211-0893
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S211-0893
  • 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 S211-0893 available by request