C289-0563 Screening compound: 1-[4-(4-methoxyphenyl)piperazin-1-yl]-3-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]propan-1-one

C289-0563 Screening compound: 1-[4-(4-methoxyphenyl)piperazin-1-yl]-3-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]propan-1-one
C289-0563 Screening compound: 1-[4-(4-methoxyphenyl)piperazin-1-yl]-3-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]propan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound C289-0563
1-[4-(4-methoxyphenyl)piperazin-1-yl]-3-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]propan-1-one

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

C289-0563

Molecular Formula

C23H26N4O3 (C23 H26 N4 O3)

Compound Name

1-[4-(4-methoxyphenyl)piperazin-1-yl]-3-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]propan-1-one

IUPAC name

1-[4-(4-methoxyphenyl)piperazin-1-yl]-3-[3-(4-methylphenyl)-124-oxadiazol-5-yl]propan-1-one

SMILES

Cc(cc1)ccc1-c1noc(CCC(N(CC2)CCN2c(cc2)ccc2OC)=O)n1

InChI

InChI=1S/C23H26N4O3/c1-17-3-5-18(6-4-17)23-24-21(30-25-23)11-12-22(28)27-15-13-26(14-16-27)19-7-9-20(29-2)10-8-19/h3-10H,11-16H2,1-2H3

InChI Key

WTPQTKDXXMRNLQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14741200

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

406.48

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.159

Distribution Coefficient, logD

4.159

Water Solubility, LogSw

-4.12

Polar Surface Area

58.506

Acid Dissociation Constant (pKa)

23.79

Base Dissociation Constant (pKb)

7.53

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

34.80

C289-0563 in Drug Discovery

Included in Screening Libraries

CNS targets activity set (6557 compounds)

Human Ion Channels Annotated Library (353 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C289-0563 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C289-0563?
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What is the minimum amount of C289-0563 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C289-0563
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C289-0563
  • 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 C289-0563 available by request