S259-0820 Screening compound: 1-(2,6-difluorobenzoyl)-4-[(5-methyl-1,2-oxazol-4-yl)methyl]piperazine

S259-0820 Screening compound: 1-(2,6-difluorobenzoyl)-4-[(5-methyl-1,2-oxazol-4-yl)methyl]piperazine
S259-0820 Screening compound: 1-(2,6-difluorobenzoyl)-4-[(5-methyl-1,2-oxazol-4-yl)methyl]piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound S259-0820
1-(2,6-difluorobenzoyl)-4-[(5-methyl-1,2-oxazol-4-yl)methyl]piperazine

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

S259-0820

Molecular Formula

C16H17F2N3O2 (C16 H17 F2 N3 O2)

Compound Name

1-(2,6-difluorobenzoyl)-4-[(5-methyl-1,2-oxazol-4-yl)methyl]piperazine

IUPAC name

1-(26-difluorobenzoyl)-4-[(5-methyl-12-oxazol-4-yl)methyl]piperazine

SMILES

Cc1c(CN(CC2)CCN2C(c(c(F)ccc2)c2F)=O)cno1

InChI

InChI=1S/C16H17F2N3O2/c1-11-12(9-19-23-11)10-20-5-7-21(8-6-20)16(22)15-13(17)3-2-4-14(15)18/h2-4,9H,5-8,10H2,1H3

InChI Key

PDFKPWPKAUBEKN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD28995638

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

321.33

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

1.218

Distribution Coefficient, logD

0.711

Water Solubility, LogSw

-1.72

Polar Surface Area

42.312

Acid Dissociation Constant (pKa)

25.27

Base Dissociation Constant (pKb)

7.75

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.50

S259-0820 in Drug Discovery

Included in Screening Libraries

Bromodomain Modulators Library (5801 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with S259-0820 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S259-0820?
Check Price and Availability of S259-0820, 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 S259-0820 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S259-0820
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S259-0820
  • 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 S259-0820 available by request