Y031-7868 Screening compound: (2,4-dichlorophenyl)(4-methylpiperazino)methanone

Y031-7868 Screening compound: (2,4-dichlorophenyl)(4-methylpiperazino)methanone
Y031-7868 Screening compound: (2,4-dichlorophenyl)(4-methylpiperazino)methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound Y031-7868
(2,4-dichlorophenyl)(4-methylpiperazino)methanone

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

Y031-7868

Molecular Formula

C12H14Cl2N2O (C12 H14 Cl2 N2 O)

Compound Name

(2,4-dichlorophenyl)(4-methylpiperazino)methanone

IUPAC name

1-(24-dichlorobenzoyl)-4-methylpiperazine

SMILES

CN(CC1)CCN1C(c(ccc(Cl)c1)c1Cl)=O

InChI

InChI=1S/C12H14Cl2N2O/c1-15-4-6-16(7-5-15)12(17)10-3-2-9(13)8-11(10)14/h2-3,8H,4-7H2,1H3

InChI Key

XKQNNTORSDLEJN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00442895

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

273.16

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

2.054

Distribution Coefficient, logD

1.924

Water Solubility, LogSw

-3.21

Polar Surface Area

20.363

Acid Dissociation Constant (pKa)

28.30

Base Dissociation Constant (pKb)

6.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

41.67

Y031-7868 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

CNS Targets (44014 compounds)

GABA Library (7115 compounds)

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system
  • Eye
  • Nervous system
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
  • Nervous system
  • Cardiovascular
Targets:
  • GPCR
  • Ion Channels
  • GPCR
  • Ion Channels
  • Ion Channels
Mechanism of action:
  • Receptor's ligands
  • Epigenetic

References: we are preparing a list of scientific research reports with Y031-7868 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y031-7868?
Check Price and Availability of Y031-7868, 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 Y031-7868 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y031-7868
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y031-7868
  • 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 Y031-7868 available by request