K784-0964 Screening compound: 2-{[(3-fluorophenyl)methyl]sulfanyl}-1-(4-phenylpiperazin-1-yl)ethan-1-one

K784-0964 Screening compound: 2-{[(3-fluorophenyl)methyl]sulfanyl}-1-(4-phenylpiperazin-1-yl)ethan-1-one
K784-0964 Screening compound: 2-{[(3-fluorophenyl)methyl]sulfanyl}-1-(4-phenylpiperazin-1-yl)ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound K784-0964
2-{[(3-fluorophenyl)methyl]sulfanyl}-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

K784-0964

Molecular Formula

C19H21FN2OS (C19 H21 FN2 OS)

Compound Name

2-{[(3-fluorophenyl)methyl]sulfanyl}-1-(4-phenylpiperazin-1-yl)ethan-1-one

IUPAC name

2-{[(3-fluorophenyl)methyl]sulfanyl}-1-(4-phenylpiperazin-1-yl)ethan-1-one

SMILES

O=C(CSCc1cc(F)ccc1)N(CC1)CCN1c1ccccc1

InChI

InChI=1S/C19H21FN2OS/c20-17-6-4-5-16(13-17)14-24-15-19(23)22-11-9-21(10-12-22)18-7-2-1-3-8-18/h1-8,13H,9-12,14-15H2

InChI Key

IFGGFZJNRYBPEH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03019513

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

344.45

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

3.854

Distribution Coefficient, logD

3.854

Water Solubility, LogSw

-4.05

Polar Surface Area

19.620

Acid Dissociation Constant (pKa)

23.00

Base Dissociation Constant (pKb)

5.55

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.60

K784-0964 in Drug Discovery

Included in Screening Libraries

Human Receptors Annotated Library (5376 compounds)

NOTUM (Wnt signaling) Library (3881 compounds)

Therapeutical Diversity Annotated Library (7563 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 K784-0964 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K784-0964?
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What is the minimum amount of K784-0964 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K784-0964
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K784-0964
  • 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 K784-0964 available by request