S614-0167 Screening compound: 2-{3-[2-(benzyloxy)ethyl]-1,2,4-oxadiazol-5-yl}-N-ethylpiperidine-1-carboxamide

S614-0167 Screening compound: 2-{3-[2-(benzyloxy)ethyl]-1,2,4-oxadiazol-5-yl}-N-ethylpiperidine-1-carboxamide
S614-0167 Screening compound: 2-{3-[2-(benzyloxy)ethyl]-1,2,4-oxadiazol-5-yl}-N-ethylpiperidine-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound S614-0167
2-{3-[2-(benzyloxy)ethyl]-1,2,4-oxadiazol-5-yl}-N-ethylpiperidine-1-carboxamide

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

S614-0167

Molecular Formula

C19H26N4O3 (C19 H26 N4 O3)

Compound Name

2-{3-[2-(benzyloxy)ethyl]-1,2,4-oxadiazol-5-yl}-N-ethylpiperidine-1-carboxamide

IUPAC name

2-{3-[2-(benzyloxy)ethyl]-124-oxadiazol-5-yl}-N-ethylpiperidine-1-carboxamide

SMILES

CCNC(N(CCCC1)C1c1nc(CCOCc2ccccc2)no1)=O

InChI

InChI=1S/C19H26N4O3/c1-2-20-19(24)23-12-7-6-10-16(23)18-21-17(22-26-18)11-13-25-14-15-8-4-3-5-9-15/h3-5,8-9,16H,2,6-7,10-14H2,1H3,(H,20,24)/t16-/m0/s1

InChI Key

WJSFPQWEIPZACC-INIZCTEOSA-N

MDL Number (MFCD)

MFCD31979196

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

358.44

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.848

Distribution Coefficient, logD

2.848

Water Solubility, LogSw

-3.17

Polar Surface Area

67.370

Acid Dissociation Constant (pKa)

17.12

Base Dissociation Constant (pKb)

2.02

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

52.63

S614-0167 in Drug Discovery

Included in Screening Libraries

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

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Cyclic compounds

References: we are preparing a list of scientific research reports with S614-0167 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S614-0167?
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What is the minimum amount of S614-0167 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S614-0167
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S614-0167
  • 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 S614-0167 available by request