SA68-0966 Screening compound: N-{2-[(1-acetylpiperidin-4-yl)(oxan-4-yl)amino]ethyl}-2-(4-fluorophenyl)acetamide

SA68-0966 Screening compound: N-{2-[(1-acetylpiperidin-4-yl)(oxan-4-yl)amino]ethyl}-2-(4-fluorophenyl)acetamide
SA68-0966 Screening compound: N-{2-[(1-acetylpiperidin-4-yl)(oxan-4-yl)amino]ethyl}-2-(4-fluorophenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SA68-0966
N-{2-[(1-acetylpiperidin-4-yl)(oxan-4-yl)amino]ethyl}-2-(4-fluorophenyl)acetamide

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

SA68-0966

Molecular Formula

C22H32FN3O3 (C22 H32 FN3 O3)

Compound Name

N-{2-[(1-acetylpiperidin-4-yl)(oxan-4-yl)amino]ethyl}-2-(4-fluorophenyl)acetamide

IUPAC name

N-{2-[(1-acetylpiperidin-4-yl)(oxan-4-yl)amino]ethyl}-2-(4-fluorophenyl)acetamide

SMILES

CC(N(CC1)CCC1N(CCNC(Cc(cc1)ccc1F)=O)C1CCOCC1)=O

InChI

InChI=1S/C22H32FN3O3/c1-17(27)25-11-6-20(7-12-25)26(21-8-14-29-15-9-21)13-10-24-22(28)16-18-2-4-19(23)5-3-18/h2-5,20-21H,6-16H2,1H3,(H,24,28)

InChI Key

OCSCATHVGVPHRH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD32239217

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

405.51

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.521

Distribution Coefficient, logD

-1.285

Water Solubility, LogSw

-1.94

Polar Surface Area

51.455

Acid Dissociation Constant (pKa)

13.37

Base Dissociation Constant (pKb)

10.20

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

63.64

SA68-0966 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with SA68-0966 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SA68-0966?
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What is the minimum amount of SA68-0966 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SA68-0966
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SA68-0966
  • 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 SA68-0966 available by request