V006-2459 Screening compound: ethyl 1-{[5-(3,4-dichlorophenyl)-3-pyridyl]methyl}-3-piperidinecarboxylate

V006-2459 Screening compound: ethyl 1-{[5-(3,4-dichlorophenyl)-3-pyridyl]methyl}-3-piperidinecarboxylate
V006-2459 Screening compound: ethyl 1-{[5-(3,4-dichlorophenyl)-3-pyridyl]methyl}-3-piperidinecarboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V006-2459
ethyl 1-{[5-(3,4-dichlorophenyl)-3-pyridyl]methyl}-3-piperidinecarboxylate

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

V006-2459

Molecular Formula

C20H22Cl2N2O2 (C20 H22 Cl2 N2 O2)

Compound Name

ethyl 1-{[5-(3,4-dichlorophenyl)-3-pyridyl]methyl}-3-piperidinecarboxylate

IUPAC name

ethyl 1-{[5-(34-dichlorophenyl)pyridin-3-yl]methyl}piperidine-3-carboxylate

SMILES

CCOC(C1CN(Cc2cc(-c(cc3)cc(Cl)c3Cl)cnc2)CCC1)=O

InChI

InChI=1S/C20H22Cl2N2O2/c1-2-26-20(25)16-4-3-7-24(13-16)12-14-8-17(11-23-10-14)15-5-6-18(21)19(22)9-15/h5-6,8-11,16H,2-4,7,12-13H2,1H3/t16-/m0/s1

InChI Key

YUQRUPAUJDCAHZ-INIZCTEOSA-N

MDL Number (MFCD)

MFCD19901606

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

393.31

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.466

Distribution Coefficient, logD

4.391

Water Solubility, LogSw

-4.53

Polar Surface Area

33.994

Acid Dissociation Constant (pKa)

22.31

Base Dissociation Constant (pKb)

6.68

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

40.00

V006-2459 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 V006-2459 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V006-2459?
Check Price and Availability of V006-2459, 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 V006-2459 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V006-2459
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V006-2459
  • 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 V006-2459 available by request