1823-0659 Screening compound: 1-(4-benzylpiperazin-1-yl)-9,10-dihydroanthracene-9,10-dione

1823-0659 Screening compound: 1-(4-benzylpiperazin-1-yl)-9,10-dihydroanthracene-9,10-dione
1823-0659 Screening compound: 1-(4-benzylpiperazin-1-yl)-9,10-dihydroanthracene-9,10-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 1823-0659
1-(4-benzylpiperazin-1-yl)-9,10-dihydroanthracene-9,10-dione

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

1823-0659

Molecular Formula

C25H22N2O2 (C25 H22 N2 O2)

Compound Name

1-(4-benzylpiperazin-1-yl)-9,10-dihydroanthracene-9,10-dione

IUPAC name

1-(4-benzylpiperazin-1-yl)-910-dihydroanthracene-910-dione

SMILES

O=C(c1c2cccc1)c1cccc(N3CCN(Cc4ccccc4)CC3)c1C2=O

InChI

InChI=1S/C25H22N2O2/c28-24-19-9-4-5-10-20(19)25(29)23-21(24)11-6-12-22(23)27-15-13-26(14-16-27)17-18-7-2-1-3-8-18/h1-12H,13-17H2

InChI Key

CCWDECXWVMFELC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01029129

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

382.46

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.958

Distribution Coefficient, logD

4.812

Water Solubility, LogSw

-4.94

Polar Surface Area

32.872

Acid Dissociation Constant (pKa)

27.97

Base Dissociation Constant (pKb)

7.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

1823-0659 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

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

DGK Inhibitors Library (10558 compounds)

SH2 Library (10483 compounds)

Voltage-Gated Ion Channel-Targeted Library (4740 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
  • Cancer
  • Endocrine
  • Nervous system
Targets:
  • Kinases
  • Ion Channels
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with 1823-0659 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1823-0659?
Check Price and Availability of 1823-0659, 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 1823-0659 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1823-0659
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1823-0659
  • 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 1823-0659 available by request