Y043-4351 Screening compound: 3-(4-chlorophenyl)-1-{4-[2-(2-pyridyl)ethyl]piperazino}-4-(1H-1,2,3,4-tetraazol-1-yl)-1-butanone

Y043-4351 Screening compound: 3-(4-chlorophenyl)-1-{4-[2-(2-pyridyl)ethyl]piperazino}-4-(1H-1,2,3,4-tetraazol-1-yl)-1-butanone
Y043-4351 Screening compound: 3-(4-chlorophenyl)-1-{4-[2-(2-pyridyl)ethyl]piperazino}-4-(1H-1,2,3,4-tetraazol-1-yl)-1-butanone alternative view

Chemical Structure Depiction of ChemDiv screening compound Y043-4351
3-(4-chlorophenyl)-1-{4-[2-(2-pyridyl)ethyl]piperazino}-4-(1H-1,2,3,4-tetraazol-1-yl)-1-butanone

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

Y043-4351

Molecular Formula

C22H26ClN7O (C22 H26 ClN7 O)

Compound Name

3-(4-chlorophenyl)-1-{4-[2-(2-pyridyl)ethyl]piperazino}-4-(1H-1,2,3,4-tetraazol-1-yl)-1-butanone

IUPAC name

3-(4-chlorophenyl)-1-{4-[2-(pyridin-2-yl)ethyl]piperazin-1-yl}-4-(1H-1234-tetrazol-1-yl)butan-1-one

SMILES

O=C(CC(Cn1nnnc1)c(cc1)ccc1Cl)N1CCN(CCc2ncccc2)CC1

InChI

InChI=1S/C22H26ClN7O/c23-20-6-4-18(5-7-20)19(16-30-17-25-26-27-30)15-22(31)29-13-11-28(12-14-29)10-8-21-3-1-2-9-24-21/h1-7,9,17,19H,8,10-16H2/t19-/m0/s1

InChI Key

XEYPNJDUWCDNTK-IBGZPJMESA-N

MDL Number (MFCD)

MFCD28028987

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

439.95

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.273

Distribution Coefficient, logD

2.230

Water Solubility, LogSw

-3.02

Polar Surface Area

69.335

Acid Dissociation Constant (pKa)

19.82

Base Dissociation Constant (pKb)

6.42

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

40.91

Y043-4351 in Drug Discovery

Included in Screening Libraries

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

Lipid Metabolism Library (9174 compounds)

RAR (Nuclear receptors) Ligands Library (6524 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Metabolic
  • Cancer
  • Respiratory tract
  • Eye
  • Male
  • Female
  • Hemic and lymphatic
  • Congenital
  • Skin
  • Endocrine
  • Immune system
  • Nervous system
  • Cardiovascular
Targets:
  • Nuclear receptors
  • Ion Channels
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with Y043-4351 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y043-4351?
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What is the minimum amount of Y043-4351 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y043-4351
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y043-4351
  • 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 Y043-4351 available by request