C204-0342 Screening compound: N'-[2-(4-chlorophenyl)ethyl]-N-[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]butanediamide

C204-0342 Screening compound: N'-[2-(4-chlorophenyl)ethyl]-N-[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]butanediamide
C204-0342 Screening compound: N'-[2-(4-chlorophenyl)ethyl]-N-[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]butanediamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C204-0342
N'-[2-(4-chlorophenyl)ethyl]-N-[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]butanediamide

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

C204-0342

Molecular Formula

C27H32ClN5O2 (C27 H32 ClN5 O2)

Compound Name

N'-[2-(4-chlorophenyl)ethyl]-N-[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]butanediamide

IUPAC name

N'-[2-(4-chlorophenyl)ethyl]-N-[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]butanediamide

SMILES

Cc1c(cc(cc2)NC(CCC(NCCc(cc3)ccc3Cl)=O)=O)c2nc(N2CCN(C)CC2)c1

InChI

InChI=1S/C27H32ClN5O2/c1-19-17-25(33-15-13-32(2)14-16-33)31-24-8-7-22(18-23(19)24)30-27(35)10-9-26(34)29-12-11-20-3-5-21(28)6-4-20/h3-8,17-18H,9-16H2,1-2H3,(H,29,34)(H,30,35)

InChI Key

ADVSKIXXIGPFPI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14732037

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

494.04

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.675

Distribution Coefficient, logD

3.105

Water Solubility, LogSw

-4.06

Polar Surface Area

62.152

Acid Dissociation Constant (pKa)

11.10

Base Dissociation Constant (pKb)

7.83

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.00

C204-0342 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

CNS Targets (44014 compounds)

SmartTM Library (51161 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Epigenetics Focused Set (26518 compounds)

Histone Deacetylases (HDAC) Targeted Library (9760 compounds)

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

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Nervous system
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Endocrine
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with C204-0342 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C204-0342?
Check Price and Availability of C204-0342, 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 C204-0342 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C204-0342
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C204-0342
  • 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 C204-0342 available by request