S322-0052 Screening compound: 1-(2,4-dichlorophenyl)-4-{[4,4-di(1H-indol-3-yl)piperidino]carbonyl}-2-pyrrolidinone

S322-0052 Screening compound: 1-(2,4-dichlorophenyl)-4-{[4,4-di(1H-indol-3-yl)piperidino]carbonyl}-2-pyrrolidinone
S322-0052 Screening compound: 1-(2,4-dichlorophenyl)-4-{[4,4-di(1H-indol-3-yl)piperidino]carbonyl}-2-pyrrolidinone alternative view

Chemical Structure Depiction of ChemDiv screening compound S322-0052
1-(2,4-dichlorophenyl)-4-{[4,4-di(1H-indol-3-yl)piperidino]carbonyl}-2-pyrrolidinone

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

S322-0052

Molecular Formula

C32H28Cl2N4O2 (C32 H28 Cl2 N4 O2)

Compound Name

1-(2,4-dichlorophenyl)-4-{[4,4-di(1H-indol-3-yl)piperidino]carbonyl}-2-pyrrolidinone

IUPAC name

4-[44-bis(1H-indol-3-yl)piperidine-1-carbonyl]-1-(24-dichlorophenyl)pyrrolidin-2-one

SMILES

O=C(C(CC1=O)CN1c(ccc(Cl)c1)c1Cl)N(CC1)CCC1(c1c[nH]c2c1cccc2)c1c[nH]c2c1cccc2

InChI

InChI=1S/C32H28Cl2N4O2/c33-21-9-10-29(26(34)16-21)38-19-20(15-30(38)39)31(40)37-13-11-32(12-14-37,24-17-35-27-7-3-1-5-22(24)27)25-18-36-28-8-4-2-6-23(25)28/h1-10,16-18,20,35-36H,11-15,19H2/t20-/m1/s1

InChI Key

SDIKGDKWXHGNMI-HXUWFJFHSA-N

MDL Number (MFCD)

MFCD27617980

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

571.51

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.177

Distribution Coefficient, logD

6.177

Water Solubility, LogSw

-6.17

Polar Surface Area

52.534

Acid Dissociation Constant (pKa)

13.04

Base Dissociation Constant (pKb)

-3.13

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

25.00

S322-0052 in Drug Discovery

Included in Screening Libraries

DGK Inhibitors Library (10558 compounds)

Indole Derivatives (10091 compounds)

MDM2-p53 interaction inhibitors Library (21687 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
  • Cancer
Targets:
  • Kinases
Structure:
  • Cyclic compounds
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with S322-0052 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S322-0052?
Check Price and Availability of S322-0052, 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 S322-0052 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S322-0052
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S322-0052
  • 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 S322-0052 available by request