V008-2215 Screening compound: methyl 4-({2-[4-(3-cyanobenzoyl)piperazin-1-yl]-1-(3-methoxyphenyl)ethoxy}methyl)benzoate

V008-2215 Screening compound: methyl 4-({2-[4-(3-cyanobenzoyl)piperazin-1-yl]-1-(3-methoxyphenyl)ethoxy}methyl)benzoate
V008-2215 Screening compound: methyl 4-({2-[4-(3-cyanobenzoyl)piperazin-1-yl]-1-(3-methoxyphenyl)ethoxy}methyl)benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound V008-2215
methyl 4-({2-[4-(3-cyanobenzoyl)piperazin-1-yl]-1-(3-methoxyphenyl)ethoxy}methyl)benzoate

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

V008-2215

Molecular Formula

C30H31N3O5 (C30 H31 N3 O5)

Compound Name

methyl 4-({2-[4-(3-cyanobenzoyl)piperazin-1-yl]-1-(3-methoxyphenyl)ethoxy}methyl)benzoate

IUPAC name

methyl 4-({2-[4-(3-cyanobenzoyl)piperazin-1-yl]-1-(3-methoxyphenyl)ethoxy}methyl)benzoate

SMILES

COC(c1ccc(COC(CN(CC2)CCN2C(c2cc(C#N)ccc2)=O)c2cc(OC)ccc2)cc1)=O

InChI

InChI=1S/C30H31N3O5/c1-36-27-8-4-6-25(18-27)28(38-21-22-9-11-24(12-10-22)30(35)37-2)20-32-13-15-33(16-14-32)29(34)26-7-3-5-23(17-26)19-31/h3-12,17-18,28H,13-16,20-21H2,1-2H3/t28-/m0/s1

InChI Key

FYWWJCYCDMZDKO-NDEPHWFRSA-N

MDL Number (MFCD)

MFCD19952644

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

513.59

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.573

Distribution Coefficient, logD

3.572

Water Solubility, LogSw

-3.65

Polar Surface Area

73.082

Acid Dissociation Constant (pKa)

23.56

Base Dissociation Constant (pKb)

4.94

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

30.00

V008-2215 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 V008-2215 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V008-2215?
Check Price and Availability of V008-2215, 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 V008-2215 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V008-2215
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V008-2215
  • 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 V008-2215 available by request