V012-8862 Screening compound: ethyl 4-{4-[(4-chlorophenyl)(phenyl)methyl]piperazin-1-yl}-4-oxobutanoate

V012-8862 Screening compound: ethyl 4-{4-[(4-chlorophenyl)(phenyl)methyl]piperazin-1-yl}-4-oxobutanoate
V012-8862 Screening compound: ethyl 4-{4-[(4-chlorophenyl)(phenyl)methyl]piperazin-1-yl}-4-oxobutanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound V012-8862
ethyl 4-{4-[(4-chlorophenyl)(phenyl)methyl]piperazin-1-yl}-4-oxobutanoate

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

V012-8862

Molecular Formula

C23H27ClN2O3 (C23 H27 ClN2 O3)

Compound Name

ethyl 4-{4-[(4-chlorophenyl)(phenyl)methyl]piperazin-1-yl}-4-oxobutanoate

IUPAC name

ethyl 4-{4-[(4-chlorophenyl)(phenyl)methyl]piperazin-1-yl}-4-oxobutanoate

SMILES

CCOC(CCC(N(CC1)CCN1C(c1ccccc1)c(cc1)ccc1Cl)=O)=O

InChI

InChI=1S/C23H27ClN2O3/c1-2-29-22(28)13-12-21(27)25-14-16-26(17-15-25)23(18-6-4-3-5-7-18)19-8-10-20(24)11-9-19/h3-11,23H,2,12-17H2,1H3/t23-/m0/s1

InChI Key

NCXKWHNYWUPZQF-QHCPKHFHSA-N

MDL Number (MFCD)

MFCD19962925

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

414.93

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.952

Distribution Coefficient, logD

3.951

Water Solubility, LogSw

-4.57

Polar Surface Area

39.351

Acid Dissociation Constant (pKa)

23.63

Base Dissociation Constant (pKb)

4.76

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

39.10

V012-8862 in Drug Discovery

Included in Screening Libraries

DGK Inhibitors Library (10558 compounds)

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
  • Nervous system
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Kinases
  • GPCR
  • Ion Channels
  • Proteases

References: we are preparing a list of scientific research reports with V012-8862 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V012-8862?
Check Price and Availability of V012-8862, 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 V012-8862 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V012-8862
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V012-8862
  • 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 V012-8862 available by request