SA68-0971 Screening compound: N-{2-[(1-acetylpiperidin-4-yl)(oxan-4-yl)amino]ethyl}-1H-indole-6-carboxamide

SA68-0971 Screening compound: N-{2-[(1-acetylpiperidin-4-yl)(oxan-4-yl)amino]ethyl}-1H-indole-6-carboxamide
SA68-0971 Screening compound: N-{2-[(1-acetylpiperidin-4-yl)(oxan-4-yl)amino]ethyl}-1H-indole-6-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SA68-0971
N-{2-[(1-acetylpiperidin-4-yl)(oxan-4-yl)amino]ethyl}-1H-indole-6-carboxamide

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

SA68-0971

Molecular Formula

C23H32N4O3 (C23 H32 N4 O3)

Compound Name

N-{2-[(1-acetylpiperidin-4-yl)(oxan-4-yl)amino]ethyl}-1H-indole-6-carboxamide

IUPAC name

N-{2-[(1-acetylpiperidin-4-yl)(oxan-4-yl)amino]ethyl}-1H-indole-6-carboxamide

SMILES

CC(N(CC1)CCC1N(CCNC(c1cc([nH]cc2)c2cc1)=O)C1CCOCC1)=O

InChI

InChI=1S/C23H32N4O3/c1-17(28)26-11-5-20(6-12-26)27(21-7-14-30-15-8-21)13-10-25-23(29)19-3-2-18-4-9-24-22(18)16-19/h2-4,9,16,20-21,24H,5-8,10-15H2,1H3,(H,25,29)

InChI Key

AOHLFBPQFYPTHN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD32239221

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

412.53

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.160

Distribution Coefficient, logD

0.182

Water Solubility, LogSw

-2.93

Polar Surface Area

61.450

Acid Dissociation Constant (pKa)

12.84

Base Dissociation Constant (pKb)

9.37

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

56.52

SA68-0971 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Mimetics
Mechanism of action:
  • PPI modulators
Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with SA68-0971 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SA68-0971?
Check Price and Availability of SA68-0971, 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 SA68-0971 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SA68-0971
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SA68-0971
  • 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 SA68-0971 available by request