V002-1224 Screening compound: methyl 5-{4-[2-(4-chlorophenyl)-2-[(3-methylphenyl)methoxy]ethyl]piperazin-1-yl}-5-oxopentanoate

V002-1224 Screening compound: methyl 5-{4-[2-(4-chlorophenyl)-2-[(3-methylphenyl)methoxy]ethyl]piperazin-1-yl}-5-oxopentanoate
V002-1224 Screening compound: methyl 5-{4-[2-(4-chlorophenyl)-2-[(3-methylphenyl)methoxy]ethyl]piperazin-1-yl}-5-oxopentanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound V002-1224
methyl 5-{4-[2-(4-chlorophenyl)-2-[(3-methylphenyl)methoxy]ethyl]piperazin-1-yl}-5-oxopentanoate

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

V002-1224

Molecular Formula

C26H33ClN2O4 (C26 H33 ClN2 O4)

Compound Name

methyl 5-{4-[2-(4-chlorophenyl)-2-[(3-methylphenyl)methoxy]ethyl]piperazin-1-yl}-5-oxopentanoate

IUPAC name

methyl 5-{4-[2-(4-chlorophenyl)-2-[(3-methylphenyl)methoxy]ethyl]piperazin-1-yl}-5-oxopentanoate

SMILES

Cc1cccc(COC(CN(CC2)CCN2C(CCCC(OC)=O)=O)c(cc2)ccc2Cl)c1

InChI

InChI=1S/C26H33ClN2O4/c1-20-5-3-6-21(17-20)19-33-24(22-9-11-23(27)12-10-22)18-28-13-15-29(16-14-28)25(30)7-4-8-26(31)32-2/h3,5-6,9-12,17,24H,4,7-8,13-16,18-19H2,1-2H3/t24-/m0/s1

InChI Key

PKFRTHLPDOXYRH-DEOSSOPVSA-N

MDL Number (MFCD)

MFCD19952567

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

473.01

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.897

Distribution Coefficient, logD

3.891

Water Solubility, LogSw

-4.55

Polar Surface Area

47.631

Acid Dissociation Constant (pKa)

22.30

Base Dissociation Constant (pKb)

5.54

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

46.15

V002-1224 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 V002-1224 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V002-1224?
Check Price and Availability of V002-1224, 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 V002-1224 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V002-1224
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V002-1224
  • 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 V002-1224 available by request