SA73-0187 Screening compound: 3-{3-[4-(cyclopropylmethyl)-1-[(3-fluoropyridin-4-yl)methyl]piperidin-4-yl]-1,2,4-oxadiazol-5-yl}pyridine

SA73-0187 Screening compound: 3-{3-[4-(cyclopropylmethyl)-1-[(3-fluoropyridin-4-yl)methyl]piperidin-4-yl]-1,2,4-oxadiazol-5-yl}pyridine
SA73-0187 Screening compound: 3-{3-[4-(cyclopropylmethyl)-1-[(3-fluoropyridin-4-yl)methyl]piperidin-4-yl]-1,2,4-oxadiazol-5-yl}pyridine alternative view

Chemical Structure Depiction of ChemDiv screening compound SA73-0187
3-{3-[4-(cyclopropylmethyl)-1-[(3-fluoropyridin-4-yl)methyl]piperidin-4-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

SA73-0187

Molecular Formula

C22H24FN5O (C22 H24 FN5 O)

Compound Name

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

IUPAC name

3-{3-[4-(cyclopropylmethyl)-1-[(3-fluoropyridin-4-yl)methyl]piperidin-4-yl]-124-oxadiazol-5-yl}pyridine

SMILES

Fc1c(CN(CC2)CCC2(CC2CC2)c2noc(-c3cnccc3)n2)ccnc1

InChI

InChI=1S/C22H24FN5O/c23-19-14-25-9-5-18(19)15-28-10-6-22(7-11-28,12-16-3-4-16)21-26-20(29-27-21)17-2-1-8-24-13-17/h1-2,5,8-9,13-14,16H,3-4,6-7,10-12,15H2

InChI Key

MTSRSGZNHLASRZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD32240801

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

393.46

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

3.336

Distribution Coefficient, logD

3.242

Water Solubility, LogSw

-3.04

Polar Surface Area

54.664

Acid Dissociation Constant (pKa)

25.20

Base Dissociation Constant (pKb)

6.78

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

45.46

SA73-0187 in Drug Discovery

Included in Screening Libraries

3CLpro Library (4801 compounds)

3D-Pharmacophore Based Diversity Library (49813 compounds)

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

CORONAVIRUS Library (20774 compounds)

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

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with SA73-0187 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SA73-0187?
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What is the minimum amount of SA73-0187 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SA73-0187
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SA73-0187
  • 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 SA73-0187 available by request