SA68-1027 Screening compound: N-{2-[(1-acetylpiperidin-4-yl)(oxan-4-yl)amino]ethyl}-3,5-dimethyl-1,2-oxazole-4-sulfonamide

SA68-1027 Screening compound: N-{2-[(1-acetylpiperidin-4-yl)(oxan-4-yl)amino]ethyl}-3,5-dimethyl-1,2-oxazole-4-sulfonamide
SA68-1027 Screening compound: N-{2-[(1-acetylpiperidin-4-yl)(oxan-4-yl)amino]ethyl}-3,5-dimethyl-1,2-oxazole-4-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SA68-1027
N-{2-[(1-acetylpiperidin-4-yl)(oxan-4-yl)amino]ethyl}-3,5-dimethyl-1,2-oxazole-4-sulfonamide

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

SA68-1027

Molecular Formula

C19H32N4O5S (C19 H32 N4 O5 S)

Compound Name

N-{2-[(1-acetylpiperidin-4-yl)(oxan-4-yl)amino]ethyl}-3,5-dimethyl-1,2-oxazole-4-sulfonamide

IUPAC name

N-{2-[(1-acetylpiperidin-4-yl)(oxan-4-yl)amino]ethyl}-35-dimethyl-12-oxazole-4-sulfonamide

SMILES

CC(N(CC1)CCC1N(CCNS(c1c(C)onc1C)(=O)=O)C1CCOCC1)=O

InChI

InChI=1S/C19H32N4O5S/c1-14-19(15(2)28-21-14)29(25,26)20-8-11-23(18-6-12-27-13-7-18)17-4-9-22(10-5-17)16(3)24/h17-18,20H,4-13H2,1-3H3

InChI Key

ARYDUZQHNHGLPL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD32239321

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

428.55

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

0.819

Distribution Coefficient, logD

-0.911

Water Solubility, LogSw

-1.95

Polar Surface Area

91.052

Acid Dissociation Constant (pKa)

9.79

Base Dissociation Constant (pKb)

9.12

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

78.95

SA68-1027 in Drug Discovery

Included in Screening Libraries

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with SA68-1027 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SA68-1027?
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What is the minimum amount of SA68-1027 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SA68-1027
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SA68-1027
  • 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 SA68-1027 available by request