1898-0014 Screening compound: 4-methyl-2-(4-phenylpiperazin-1-yl)quinoline

1898-0014 Screening compound: 4-methyl-2-(4-phenylpiperazin-1-yl)quinoline
1898-0014 Screening compound: 4-methyl-2-(4-phenylpiperazin-1-yl)quinoline alternative view

Chemical Structure Depiction of ChemDiv screening compound 1898-0014
4-methyl-2-(4-phenylpiperazin-1-yl)quinoline

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

1898-0014

Molecular Formula

C20H21N3 (C20 H21 N3)

Compound Name

4-methyl-2-(4-phenylpiperazin-1-yl)quinoline

IUPAC name

4-methyl-2-(4-phenylpiperazin-1-yl)quinoline

SMILES

Cc1cc(N(CC2)CCN2c2ccccc2)nc2ccccc12

InChI

InChI=1S/C20H21N3/c1-16-15-20(21-19-10-6-5-9-18(16)19)23-13-11-22(12-14-23)17-7-3-2-4-8-17/h2-10,15H,11-14H2,1H3

InChI Key

AFQIQSADFDGFML-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01067932

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

303.41

Hydrogen Bond Acceptors Count

1.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.064

Distribution Coefficient, logD

5.061

Water Solubility, LogSw

-4.91

Polar Surface Area

14.745

Acid Dissociation Constant (pKa)

24.01

Base Dissociation Constant (pKb)

5.27

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

1898-0014 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Anti-Aging Library (44940 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

GPCR Targeted Library (31838 compounds)

STING Agonist Library (5895 compounds)

SmartTM Library (51161 compounds)

Targeted Diversity Library (40567 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

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

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Cancer
  • Immune system
Mechanism of action:
  • Epigenetic
  • Receptor's ligands
Targets:
  • GPCR
  • Others

References: we are preparing a list of scientific research reports with 1898-0014 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1898-0014?
Check Price and Availability of 1898-0014, 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 1898-0014 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1898-0014
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1898-0014
  • 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 1898-0014 available by request