SA71-1290 Screening compound: 2-{3-[3-(cyclopropylmethyl)-1-(1-methyl-1H-imidazole-2-carbonyl)piperidin-3-yl]-1,2,4-oxadiazol-5-yl}pyridine

SA71-1290 Screening compound: 2-{3-[3-(cyclopropylmethyl)-1-(1-methyl-1H-imidazole-2-carbonyl)piperidin-3-yl]-1,2,4-oxadiazol-5-yl}pyridine
SA71-1290 Screening compound: 2-{3-[3-(cyclopropylmethyl)-1-(1-methyl-1H-imidazole-2-carbonyl)piperidin-3-yl]-1,2,4-oxadiazol-5-yl}pyridine alternative view

Chemical Structure Depiction of ChemDiv screening compound SA71-1290
2-{3-[3-(cyclopropylmethyl)-1-(1-methyl-1H-imidazole-2-carbonyl)piperidin-3-yl]-1,2,4-oxadiazol-5-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

SA71-1290

Molecular Formula

C21H24N6O2 (C21 H24 N6 O2)

Compound Name

2-{3-[3-(cyclopropylmethyl)-1-(1-methyl-1H-imidazole-2-carbonyl)piperidin-3-yl]-1,2,4-oxadiazol-5-yl}pyridine

IUPAC name

2-{3-[3-(cyclopropylmethyl)-1-(1-methyl-1H-imidazole-2-carbonyl)piperidin-3-yl]-124-oxadiazol-5-yl}pyridine

SMILES

Cn1c(C(N(CCC2)CC2(CC2CC2)c2noc(-c3ncccc3)n2)=O)ncc1

InChI

InChI=1S/C21H24N6O2/c1-26-12-10-23-17(26)19(28)27-11-4-8-21(14-27,13-15-6-7-15)20-24-18(29-25-20)16-5-2-3-9-22-16/h2-3,5,9-10,12,15H,4,6-8,11,13-14H2,1H3/t21-/m1/s1

InChI Key

OQKJLIFSVINETD-OAQYLSRUSA-N

MDL Number (MFCD)

MFCD32240869

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

392.46

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.979

Distribution Coefficient, logD

1.979

Water Solubility, LogSw

-2.34

Polar Surface Area

69.862

Acid Dissociation Constant (pKa)

24.89

Base Dissociation Constant (pKb)

2.77

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

47.62

SA71-1290 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)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with SA71-1290 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SA71-1290?
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What is the minimum amount of SA71-1290 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SA71-1290
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SA71-1290
  • 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 SA71-1290 available by request