4606-0922 Screening compound: [3-(2,6-DICHLOROPHENYL)-5-METHYL-4-ISOXAZOLYL](4-ETHYLPIPERAZINO)METHANONE

4606-0922 Screening compound: [3-(2,6-DICHLOROPHENYL)-5-METHYL-4-ISOXAZOLYL](4-ETHYLPIPERAZINO)METHANONE
4606-0922 Screening compound: [3-(2,6-DICHLOROPHENYL)-5-METHYL-4-ISOXAZOLYL](4-ETHYLPIPERAZINO)METHANONE alternative view

Chemical Structure Depiction of ChemDiv screening compound 4606-0922
[3-(2,6-DICHLOROPHENYL)-5-METHYL-4-ISOXAZOLYL](4-ETHYLPIPERAZINO)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

4606-0922

Molecular Formula

C17H19Cl2N3O2 (C17 H19 Cl2 N3 O2)

Compound Name

[3-(2,6-DICHLOROPHENYL)-5-METHYL-4-ISOXAZOLYL](4-ETHYLPIPERAZINO)METHANONE

IUPAC name

n/a

SMILES

CCN(CC1)CCN1C(c1c(C)onc1-c(c(Cl)ccc1)c1Cl)=O

InChI

InChI=1S/C17H19Cl2N3O2/c1-3-21-7-9-22(10-8-21)17(23)14-11(2)24-20-16(14)15-12(18)5-4-6-13(15)19/h4-6H,3,7-10H2,1-2H3

InChI Key

GONSDUOKIWUVBQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02174619

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

368.26

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.560

Distribution Coefficient, logD

2.384

Water Solubility, LogSw

-3.23

Polar Surface Area

42.384

Acid Dissociation Constant (pKa)

26.73

Base Dissociation Constant (pKb)

7.10

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

41.20

4606-0922 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Antiviral Library (67538 compounds)

Dark Chemical Matter Library (18430 compounds)

Human Transcription Factors Annotated Library (5098 compounds)

Neurotransmitter Transporter Inhibitors Library (11024 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
  • Pool
Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Nervous system
Targets:
  • GPCR
  • Ion Channels

References: we are preparing a list of scientific research reports with 4606-0922 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4606-0922?
Check Price and Availability of 4606-0922, 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 4606-0922 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4606-0922
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4606-0922
  • 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 4606-0922 available by request