V029-0777 Screening compound: 1-benzyl-4-[3-(3-chlorophenyl)-3-(2-methoxyphenoxy)propyl]piperazine

V029-0777 Screening compound: 1-benzyl-4-[3-(3-chlorophenyl)-3-(2-methoxyphenoxy)propyl]piperazine
V029-0777 Screening compound: 1-benzyl-4-[3-(3-chlorophenyl)-3-(2-methoxyphenoxy)propyl]piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound V029-0777
1-benzyl-4-[3-(3-chlorophenyl)-3-(2-methoxyphenoxy)propyl]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

V029-0777

Molecular Formula

C27H31ClN2O2 (C27 H31 ClN2 O2)

Compound Name

1-benzyl-4-[3-(3-chlorophenyl)-3-(2-methoxyphenoxy)propyl]piperazine

IUPAC name

1-benzyl-4-[3-(3-chlorophenyl)-3-(2-methoxyphenoxy)propyl]piperazine

SMILES

COc(cccc1)c1OC(CCN1CCN(Cc2ccccc2)CC1)c1cccc(Cl)c1

InChI

InChI=1S/C27H31ClN2O2/c1-31-26-12-5-6-13-27(26)32-25(23-10-7-11-24(28)20-23)14-15-29-16-18-30(19-17-29)21-22-8-3-2-4-9-22/h2-13,20,25H,14-19,21H2,1H3/t25-/m0/s1

InChI Key

KBTGBFHNAPDQNT-VWLOTQADSA-N

MDL Number (MFCD)

MFCD19928858

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

451.01

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.483

Distribution Coefficient, logD

5.218

Water Solubility, LogSw

-6.08

Polar Surface Area

21.608

Acid Dissociation Constant (pKa)

26.66

Base Dissociation Constant (pKb)

7.33

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

33.30

V029-0777 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Anti-Aging Library (44940 compounds)

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Nervous system
  • Infections
  • Immune system
  • animal
Mechanism of action:
  • Epigenetic
Targets:
  • GPCR
  • Ion Channels

References: we are preparing a list of scientific research reports with V029-0777 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V029-0777?
Check Price and Availability of V029-0777, 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 V029-0777 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V029-0777
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V029-0777
  • 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 V029-0777 available by request