C528-0979 Screening compound: 2-{[2-(3-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methanesulfonyl}-1-(4-phenylpiperazin-1-yl)ethan-1-one

C528-0979 Screening compound: 2-{[2-(3-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methanesulfonyl}-1-(4-phenylpiperazin-1-yl)ethan-1-one
C528-0979 Screening compound: 2-{[2-(3-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methanesulfonyl}-1-(4-phenylpiperazin-1-yl)ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound C528-0979
2-{[2-(3-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methanesulfonyl}-1-(4-phenylpiperazin-1-yl)ethan-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

C528-0979

Molecular Formula

C24H27N3O5S (C24 H27 N3 O5 S)

Compound Name

2-{[2-(3-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methanesulfonyl}-1-(4-phenylpiperazin-1-yl)ethan-1-one

IUPAC name

2-{[2-(3-methoxyphenyl)-5-methyl-13-oxazol-4-yl]methanesulfonyl}-1-(4-phenylpiperazin-1-yl)ethan-1-one

SMILES

Cc1c(CS(CC(N(CC2)CCN2c2ccccc2)=O)(=O)=O)nc(-c2cc(OC)ccc2)o1

InChI

InChI=1S/C24H27N3O5S/c1-18-22(25-24(32-18)19-7-6-10-21(15-19)31-2)16-33(29,30)17-23(28)27-13-11-26(12-14-27)20-8-4-3-5-9-20/h3-10,15H,11-14,16-17H2,1-2H3

InChI Key

SWUZICIUGHTVCF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14767093

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

469.56

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.545

Distribution Coefficient, logD

2.545

Water Solubility, LogSw

-2.84

Polar Surface Area

73.586

Acid Dissociation Constant (pKa)

13.92

Base Dissociation Constant (pKb)

3.07

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

C528-0979 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 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

References: we are preparing a list of scientific research reports with C528-0979 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C528-0979?
Check Price and Availability of C528-0979, 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 C528-0979 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C528-0979
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C528-0979
  • 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 C528-0979 available by request