Y043-5097 Screening compound: (8-chloro-4-hydroxy-3-quinolyl){4-[2-(2-pyridyl)ethyl]piperazino}methanone

Y043-5097 Screening compound: (8-chloro-4-hydroxy-3-quinolyl){4-[2-(2-pyridyl)ethyl]piperazino}methanone
Y043-5097 Screening compound: (8-chloro-4-hydroxy-3-quinolyl){4-[2-(2-pyridyl)ethyl]piperazino}methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound Y043-5097
(8-chloro-4-hydroxy-3-quinolyl){4-[2-(2-pyridyl)ethyl]piperazino}methanone

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

Y043-5097

Molecular Formula

C21H21ClN4O2 (C21 H21 ClN4 O2)

Compound Name

(8-chloro-4-hydroxy-3-quinolyl){4-[2-(2-pyridyl)ethyl]piperazino}methanone

IUPAC name

8-chloro-3-{4-[2-(pyridin-2-yl)ethyl]piperazine-1-carbonyl}quinolin-4-ol

SMILES

Oc1c(cccc2Cl)c2ncc1C(N1CCN(CCc2ncccc2)CC1)=O

InChI

InChI=1S/C21H21ClN4O2/c22-18-6-3-5-16-19(18)24-14-17(20(16)27)21(28)26-12-10-25(11-13-26)9-7-15-4-1-2-8-23-15/h1-6,8,14H,7,9-13H2,(H,24,27)

InChI Key

RELAQIXOBBVFJP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD28366941

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

396.88

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.349

Distribution Coefficient, logD

2.297

Water Solubility, LogSw

-2.90

Polar Surface Area

55.051

Acid Dissociation Constant (pKa)

8.53

Base Dissociation Constant (pKb)

6.08

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.57

Y043-5097 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 Y043-5097 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y043-5097?
Check Price and Availability of Y043-5097, 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 Y043-5097 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y043-5097
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y043-5097
  • 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 Y043-5097 available by request