4130-3687 Screening compound: 1-(3-chlorophenyl)-4-(3,4-dichlorobenzoyl)piperazine

4130-3687 Screening compound: 1-(3-chlorophenyl)-4-(3,4-dichlorobenzoyl)piperazine
4130-3687 Screening compound: 1-(3-chlorophenyl)-4-(3,4-dichlorobenzoyl)piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound 4130-3687
1-(3-chlorophenyl)-4-(3,4-dichlorobenzoyl)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

4130-3687

Molecular Formula

C17H15Cl3N2O (C17 H15 Cl3 N2 O)

Compound Name

1-(3-chlorophenyl)-4-(3,4-dichlorobenzoyl)piperazine

IUPAC name

1-(3-chlorophenyl)-4-(34-dichlorobenzoyl)piperazine

SMILES

O=C(c(cc1)cc(Cl)c1Cl)N(CC1)CCN1c1cc(Cl)ccc1

InChI

InChI=1S/C17H15Cl3N2O/c18-13-2-1-3-14(11-13)21-6-8-22(9-7-21)17(23)12-4-5-15(19)16(20)10-12/h1-5,10-11H,6-9H2

InChI Key

XFPUYJPQKQNLPJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01215567

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

369.68

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.521

Distribution Coefficient, logD

4.521

Water Solubility, LogSw

-4.54

Polar Surface Area

20.147

Acid Dissociation Constant (pKa)

28.16

Base Dissociation Constant (pKb)

4.64

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.50

4130-3687 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Anti-Aging Library (44940 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
Targets:
  • Kinases
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 4130-3687 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4130-3687?
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What is the minimum amount of 4130-3687 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4130-3687
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4130-3687
  • 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 4130-3687 available by request