S926-2161 Screening compound: 2,6-dimethoxy-3-(3-{[5-(methoxymethyl)-1,2,4-oxadiazol-3-yl]methoxy}piperidine-1-carbonyl)pyridine

S926-2161 Screening compound: 2,6-dimethoxy-3-(3-{[5-(methoxymethyl)-1,2,4-oxadiazol-3-yl]methoxy}piperidine-1-carbonyl)pyridine
S926-2161 Screening compound: 2,6-dimethoxy-3-(3-{[5-(methoxymethyl)-1,2,4-oxadiazol-3-yl]methoxy}piperidine-1-carbonyl)pyridine alternative view

Chemical Structure Depiction of ChemDiv screening compound S926-2161
2,6-dimethoxy-3-(3-{[5-(methoxymethyl)-1,2,4-oxadiazol-3-yl]methoxy}piperidine-1-carbonyl)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

S926-2161

Molecular Formula

C18H24N4O6 (C18 H24 N4 O6)

Compound Name

2,6-dimethoxy-3-(3-{[5-(methoxymethyl)-1,2,4-oxadiazol-3-yl]methoxy}piperidine-1-carbonyl)pyridine

IUPAC name

26-dimethoxy-3-(3-{[5-(methoxymethyl)-124-oxadiazol-3-yl]methoxy}piperidine-1-carbonyl)pyridine

SMILES

COCc1nc(COC(CCC2)CN2C(c(ccc(OC)n2)c2OC)=O)no1

InChI

InChI=1S/C18H24N4O6/c1-24-11-16-19-14(21-28-16)10-27-12-5-4-8-22(9-12)18(23)13-6-7-15(25-2)20-17(13)26-3/h6-7,12H,4-5,8-11H2,1-3H3/t12-/m0/s1

InChI Key

ZINPDHMIZIWGFI-LBPRGKRZSA-N

MDL Number (MFCD)

MFCD31994182

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

392.41

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

1.486

Distribution Coefficient, logD

1.486

Water Solubility, LogSw

-2.20

Polar Surface Area

88.952

Acid Dissociation Constant (pKa)

26.15

Base Dissociation Constant (pKb)

-1.80

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

55.56

S926-2161 in Drug Discovery

Included in Screening Libraries

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

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

Protein-Protein Interaction Library (218420 compounds)

Alpha-Helix Mimetics Library (25899 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with S926-2161 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S926-2161?
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What is the minimum amount of S926-2161 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S926-2161
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S926-2161
  • 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 S926-2161 available by request