V008-2171 Screening compound: 1-{2-[(3-chlorophenyl)methoxy]-2-(3-methoxyphenyl)ethyl}-4-(2,4-dimethoxybenzoyl)piperazine

V008-2171 Screening compound: 1-{2-[(3-chlorophenyl)methoxy]-2-(3-methoxyphenyl)ethyl}-4-(2,4-dimethoxybenzoyl)piperazine
V008-2171 Screening compound: 1-{2-[(3-chlorophenyl)methoxy]-2-(3-methoxyphenyl)ethyl}-4-(2,4-dimethoxybenzoyl)piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound V008-2171
1-{2-[(3-chlorophenyl)methoxy]-2-(3-methoxyphenyl)ethyl}-4-(2,4-dimethoxybenzoyl)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

V008-2171

Molecular Formula

C29H33ClN2O5 (C29 H33 ClN2 O5)

Compound Name

1-{2-[(3-chlorophenyl)methoxy]-2-(3-methoxyphenyl)ethyl}-4-(2,4-dimethoxybenzoyl)piperazine

IUPAC name

1-{2-[(3-chlorophenyl)methoxy]-2-(3-methoxyphenyl)ethyl}-4-(24-dimethoxybenzoyl)piperazine

SMILES

COc1cccc(C(CN(CC2)CCN2C(c(ccc(OC)c2)c2OC)=O)OCc2cccc(Cl)c2)c1

InChI

InChI=1S/C29H33ClN2O5/c1-34-24-9-5-7-22(17-24)28(37-20-21-6-4-8-23(30)16-21)19-31-12-14-32(15-13-31)29(33)26-11-10-25(35-2)18-27(26)36-3/h4-11,16-18,28H,12-15,19-20H2,1-3H3/t28-/m0/s1

InChI Key

HXTLEUSXIPDFMC-NDEPHWFRSA-N

MDL Number (MFCD)

MFCD19952609

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

525.04

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.733

Distribution Coefficient, logD

4.732

Water Solubility, LogSw

-4.88

Polar Surface Area

50.026

Acid Dissociation Constant (pKa)

23.56

Base Dissociation Constant (pKb)

4.94

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

34.50

V008-2171 in Drug Discovery

Included in Screening Libraries

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
Targets:
  • GPCR
  • Ion Channels

References: we are preparing a list of scientific research reports with V008-2171 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V008-2171?
Check Price and Availability of V008-2171, 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 V008-2171 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V008-2171
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V008-2171
  • 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 V008-2171 available by request