J009-2973 Screening compound: 1-(benzenesulfonyl)-4-{1-[(3-chlorophenyl)methanesulfonyl]piperidine-3-carbonyl}piperazine

J009-2973 Screening compound: 1-(benzenesulfonyl)-4-{1-[(3-chlorophenyl)methanesulfonyl]piperidine-3-carbonyl}piperazine
J009-2973 Screening compound: 1-(benzenesulfonyl)-4-{1-[(3-chlorophenyl)methanesulfonyl]piperidine-3-carbonyl}piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound J009-2973
1-(benzenesulfonyl)-4-{1-[(3-chlorophenyl)methanesulfonyl]piperidine-3-carbonyl}piperazine

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

J009-2973

Molecular Formula

C23H28ClN3O5S2 (C23 H28 ClN3 O5 S2)

Compound Name

1-(benzenesulfonyl)-4-{1-[(3-chlorophenyl)methanesulfonyl]piperidine-3-carbonyl}piperazine

IUPAC name

1-(benzenesulfonyl)-4-{1-[(3-chlorophenyl)methanesulfonyl]piperidine-3-carbonyl}piperazine

SMILES

O=C(C(CCC1)CN1S(Cc1cccc(Cl)c1)(=O)=O)N(CC1)CCN1S(c1ccccc1)(=O)=O

InChI

InChI=1S/C23H28ClN3O5S2/c24-21-8-4-6-19(16-21)18-33(29,30)27-11-5-7-20(17-27)23(28)25-12-14-26(15-13-25)34(31,32)22-9-2-1-3-10-22/h1-4,6,8-10,16,20H,5,7,11-15,17-18H2/t20-/m0/s1

InChI Key

ZUBYIDYVRWJASI-FQEVSTJZSA-N

MDL Number (MFCD)

MFCD27216612

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

526.08

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.640

Distribution Coefficient, logD

2.640

Water Solubility, LogSw

-3.20

Polar Surface Area

79.944

Acid Dissociation Constant (pKa)

20.21

Base Dissociation Constant (pKb)

-3.61

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

43.50

J009-2973 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Targeted Diversity Library (40567 compounds)

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Mimetics

References: we are preparing a list of scientific research reports with J009-2973 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J009-2973?
Check Price and Availability of J009-2973, 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 J009-2973 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J009-2973
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J009-2973
  • 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 J009-2973 available by request