4964-2913 Screening compound: 3-[(4-benzylpiperazin-1-yl)methyl]-1H-indole

4964-2913 Screening compound: 3-[(4-benzylpiperazin-1-yl)methyl]-1H-indole
4964-2913 Screening compound: 3-[(4-benzylpiperazin-1-yl)methyl]-1H-indole alternative view

Chemical Structure Depiction of ChemDiv screening compound 4964-2913
3-[(4-benzylpiperazin-1-yl)methyl]-1H-indole

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

4964-2913

Molecular Formula

C20H23N3 (C20 H23 N3)

Compound Name

3-[(4-benzylpiperazin-1-yl)methyl]-1H-indole

IUPAC name

3-[(4-benzylpiperazin-1-yl)methyl]-1H-indole

SMILES

C(c1c[nH]c2c1cccc2)N1CCN(Cc2ccccc2)CC1

InChI

InChI=1S/C20H23N3/c1-2-6-17(7-3-1)15-22-10-12-23(13-11-22)16-18-14-21-20-9-5-4-8-19(18)20/h1-9,14,21H,10-13,15-16H2

InChI Key

YHZKIEWEQQRAHY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00396990

Chemical and Physical Properties

Saltdata

HOOCCOOH

Molecular Weight

305.42

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

3.140

Distribution Coefficient, logD

2.000

Water Solubility, LogSw

-2.85

Polar Surface Area

17.382

Acid Dissociation Constant (pKa)

18.66

Base Dissociation Constant (pKb)

8.51

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

4964-2913 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Anti-Aging Library (44940 compounds)

CNS Targets (44014 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Ion Channels Focused Library (26372 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Nervous system
  • Nervous system
  • Cardiovascular
Mechanism of action:
  • Epigenetic
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with 4964-2913 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4964-2913?
Check Price and Availability of 4964-2913, 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 4964-2913 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4964-2913
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4964-2913
  • 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 4964-2913 available by request