SA73-0227 Screening compound: 3-{3-[4-(cyclopropylmethyl)-1-(1-ethyl-1H-pyrazole-5-carbonyl)piperidin-4-yl]-1,2,4-oxadiazol-5-yl}pyridine

SA73-0227 Screening compound: 3-{3-[4-(cyclopropylmethyl)-1-(1-ethyl-1H-pyrazole-5-carbonyl)piperidin-4-yl]-1,2,4-oxadiazol-5-yl}pyridine
SA73-0227 Screening compound: 3-{3-[4-(cyclopropylmethyl)-1-(1-ethyl-1H-pyrazole-5-carbonyl)piperidin-4-yl]-1,2,4-oxadiazol-5-yl}pyridine alternative view

Chemical Structure Depiction of ChemDiv screening compound SA73-0227
3-{3-[4-(cyclopropylmethyl)-1-(1-ethyl-1H-pyrazole-5-carbonyl)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

SA73-0227

Molecular Formula

C22H26N6O2 (C22 H26 N6 O2)

Compound Name

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

IUPAC name

3-{3-[4-(cyclopropylmethyl)-1-(1-ethyl-1H-pyrazole-5-carbonyl)piperidin-4-yl]-124-oxadiazol-5-yl}pyridine

SMILES

CCn1nccc1C(N(CC1)CCC1(CC1CC1)c1noc(-c2cnccc2)n1)=O

InChI

InChI=1S/C22H26N6O2/c1-2-28-18(7-11-24-28)20(29)27-12-8-22(9-13-27,14-16-5-6-16)21-25-19(30-26-21)17-4-3-10-23-15-17/h3-4,7,10-11,15-16H,2,5-6,8-9,12-14H2,1H3

InChI Key

JIDDFFGPRRXKIY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD32241121

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

406.49

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.242

Distribution Coefficient, logD

2.149

Water Solubility, LogSw

-1.88

Polar Surface Area

71.151

Acid Dissociation Constant (pKa)

25.20

Base Dissociation Constant (pKb)

6.78

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

SA73-0227 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 SA73-0227 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SA73-0227?
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What is the minimum amount of SA73-0227 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SA73-0227
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SA73-0227
  • 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 SA73-0227 available by request