SA67-0918 Screening compound: 1-(3-{2-[5-(oxan-4-yl)-1,2,4-oxadiazol-3-yl]ethyl}pyrrolidin-1-yl)-3-(1,3,5-trimethyl-1H-pyrazol-4-yl)propan-1-one

SA67-0918 Screening compound: 1-(3-{2-[5-(oxan-4-yl)-1,2,4-oxadiazol-3-yl]ethyl}pyrrolidin-1-yl)-3-(1,3,5-trimethyl-1H-pyrazol-4-yl)propan-1-one
SA67-0918 Screening compound: 1-(3-{2-[5-(oxan-4-yl)-1,2,4-oxadiazol-3-yl]ethyl}pyrrolidin-1-yl)-3-(1,3,5-trimethyl-1H-pyrazol-4-yl)propan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound SA67-0918
1-(3-{2-[5-(oxan-4-yl)-1,2,4-oxadiazol-3-yl]ethyl}pyrrolidin-1-yl)-3-(1,3,5-trimethyl-1H-pyrazol-4-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

SA67-0918

Molecular Formula

C22H33N5O3 (C22 H33 N5 O3)

Compound Name

1-(3-{2-[5-(oxan-4-yl)-1,2,4-oxadiazol-3-yl]ethyl}pyrrolidin-1-yl)-3-(1,3,5-trimethyl-1H-pyrazol-4-yl)propan-1-one

IUPAC name

1-(3-{2-[5-(oxan-4-yl)-124-oxadiazol-3-yl]ethyl}pyrrolidin-1-yl)-3-(135-trimethyl-1H-pyrazol-4-yl)propan-1-one

SMILES

Cc1c(CCC(N2CC(CCc3noc(C4CCOCC4)n3)CC2)=O)c(C)nn1C

InChI

InChI=1S/C22H33N5O3/c1-15-19(16(2)26(3)24-15)5-7-21(28)27-11-8-17(14-27)4-6-20-23-22(30-25-20)18-9-12-29-13-10-18/h17-18H,4-14H2,1-3H3/t17-/m1/s1

InChI Key

MOFNRCJQGIWNFX-QGZVFWFLSA-N

MDL Number (MFCD)

MFCD32001533

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

415.54

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

2.058

Distribution Coefficient, logD

2.058

Water Solubility, LogSw

-1.91

Polar Surface Area

71.995

Acid Dissociation Constant (pKa)

22.19

Base Dissociation Constant (pKb)

4.09

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

72.73

SA67-0918 in Drug Discovery

Included in Screening Libraries

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 SA67-0918 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SA67-0918?
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What is the minimum amount of SA67-0918 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SA67-0918
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SA67-0918
  • 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 SA67-0918 available by request