SA70-0089 Screening compound: 3-cyclohexyl-1-[3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-3-(2-methoxyethyl)piperidin-1-yl]propan-1-one

SA70-0089 Screening compound: 3-cyclohexyl-1-[3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-3-(2-methoxyethyl)piperidin-1-yl]propan-1-one
SA70-0089 Screening compound: 3-cyclohexyl-1-[3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-3-(2-methoxyethyl)piperidin-1-yl]propan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound SA70-0089
3-cyclohexyl-1-[3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-3-(2-methoxyethyl)piperidin-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

SA70-0089

Molecular Formula

C22H35N3O3 (C22 H35 N3 O3)

Compound Name

3-cyclohexyl-1-[3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-3-(2-methoxyethyl)piperidin-1-yl]propan-1-one

IUPAC name

3-cyclohexyl-1-[3-(5-cyclopropyl-124-oxadiazol-3-yl)-3-(2-methoxyethyl)piperidin-1-yl]propan-1-one

SMILES

COCCC(CCC1)(CN1C(CCC1CCCCC1)=O)c1noc(C2CC2)n1

InChI

InChI=1S/C22H35N3O3/c1-27-15-13-22(21-23-20(28-24-21)18-9-10-18)12-5-14-25(16-22)19(26)11-8-17-6-3-2-4-7-17/h17-18H,2-16H2,1H3/t22-/m1/s1

InChI Key

ZKFJFVXPODPRGN-JOCHJYFZSA-N

MDL Number (MFCD)

MFCD32240285

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

389.54

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.470

Distribution Coefficient, logD

4.470

Water Solubility, LogSw

-4.30

Polar Surface Area

56.756

Acid Dissociation Constant (pKa)

24.22

Base Dissociation Constant (pKb)

0.78

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

86.36

SA70-0089 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 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 SA70-0089 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SA70-0089?
Check Price and Availability of SA70-0089, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of SA70-0089 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SA70-0089
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SA70-0089
  • 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 SA70-0089 available by request