SA71-0793 Screening compound: 1-[3-(cyclopropylmethyl)-3-[5-(oxan-4-yl)-1,2,4-oxadiazol-3-yl]piperidin-1-yl]-3-(4-methyl-1H-pyrazol-1-yl)propan-1-one

SA71-0793 Screening compound: 1-[3-(cyclopropylmethyl)-3-[5-(oxan-4-yl)-1,2,4-oxadiazol-3-yl]piperidin-1-yl]-3-(4-methyl-1H-pyrazol-1-yl)propan-1-one
SA71-0793 Screening compound: 1-[3-(cyclopropylmethyl)-3-[5-(oxan-4-yl)-1,2,4-oxadiazol-3-yl]piperidin-1-yl]-3-(4-methyl-1H-pyrazol-1-yl)propan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound SA71-0793
1-[3-(cyclopropylmethyl)-3-[5-(oxan-4-yl)-1,2,4-oxadiazol-3-yl]piperidin-1-yl]-3-(4-methyl-1H-pyrazol-1-yl)propan-1-one

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

SA71-0793

Molecular Formula

C23H33N5O3 (C23 H33 N5 O3)

Compound Name

1-[3-(cyclopropylmethyl)-3-[5-(oxan-4-yl)-1,2,4-oxadiazol-3-yl]piperidin-1-yl]-3-(4-methyl-1H-pyrazol-1-yl)propan-1-one

IUPAC name

1-[3-(cyclopropylmethyl)-3-[5-(oxan-4-yl)-124-oxadiazol-3-yl]piperidin-1-yl]-3-(4-methyl-1H-pyrazol-1-yl)propan-1-one

SMILES

Cc1cn(CCC(N(CCC2)CC2(CC2CC2)c2noc(C3CCOCC3)n2)=O)nc1

InChI

InChI=1S/C23H33N5O3/c1-17-14-24-28(15-17)10-5-20(29)27-9-2-8-23(16-27,13-18-3-4-18)22-25-21(31-26-22)19-6-11-30-12-7-19/h14-15,18-19H,2-13,16H2,1H3/t23-/m1/s1

InChI Key

FICUYQQXSFNDQL-HSZRJFAPSA-N

MDL Number (MFCD)

MFCD32240428

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

427.55

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.915

Distribution Coefficient, logD

2.915

Water Solubility, LogSw

-2.63

Polar Surface Area

70.806

Acid Dissociation Constant (pKa)

23.21

Base Dissociation Constant (pKb)

3.41

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

73.91

SA71-0793 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

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 SA71-0793 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SA71-0793?
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What is the minimum amount of SA71-0793 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SA71-0793
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SA71-0793
  • 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 SA71-0793 available by request