SA67-0840 Screening compound: 3-{2-[1-(2,4-dimethyl-1,3-thiazole-5-carbonyl)pyrrolidin-3-yl]ethyl}-5-(oxan-4-yl)-1,2,4-oxadiazole

SA67-0840 Screening compound: 3-{2-[1-(2,4-dimethyl-1,3-thiazole-5-carbonyl)pyrrolidin-3-yl]ethyl}-5-(oxan-4-yl)-1,2,4-oxadiazole
SA67-0840 Screening compound: 3-{2-[1-(2,4-dimethyl-1,3-thiazole-5-carbonyl)pyrrolidin-3-yl]ethyl}-5-(oxan-4-yl)-1,2,4-oxadiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound SA67-0840
3-{2-[1-(2,4-dimethyl-1,3-thiazole-5-carbonyl)pyrrolidin-3-yl]ethyl}-5-(oxan-4-yl)-1,2,4-oxadiazole

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

SA67-0840

Molecular Formula

C19H26N4O3S (C19 H26 N4 O3 S)

Compound Name

3-{2-[1-(2,4-dimethyl-1,3-thiazole-5-carbonyl)pyrrolidin-3-yl]ethyl}-5-(oxan-4-yl)-1,2,4-oxadiazole

IUPAC name

3-{2-[1-(24-dimethyl-13-thiazole-5-carbonyl)pyrrolidin-3-yl]ethyl}-5-(oxan-4-yl)-124-oxadiazole

SMILES

Cc1c(C(N2CC(CCc3noc(C4CCOCC4)n3)CC2)=O)sc(C)n1

InChI

InChI=1S/C19H26N4O3S/c1-12-17(27-13(2)20-12)19(24)23-8-5-14(11-23)3-4-16-21-18(26-22-16)15-6-9-25-10-7-15/h14-15H,3-11H2,1-2H3/t14-/m1/s1

InChI Key

SLRKFPIXLXFGMF-CQSZACIVSA-N

MDL Number (MFCD)

MFCD32001075

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

390.51

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.154

Distribution Coefficient, logD

3.154

Water Solubility, LogSw

-2.96

Polar Surface Area

68.072

Acid Dissociation Constant (pKa)

25.44

Base Dissociation Constant (pKb)

3.20

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

68.42

SA67-0840 in Drug Discovery

Included in Screening Libraries

CNS MPO Library (28609 compounds)

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

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with SA67-0840 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SA67-0840?
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What is the minimum amount of SA67-0840 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SA67-0840
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SA67-0840
  • 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 SA67-0840 available by request