K940-2779 Screening compound: N-(3-fluoro-4-methylphenyl)-2-(4-{[(2-methoxyphenyl)carbamoyl]methyl}piperazin-1-yl)acetamide

K940-2779 Screening compound: N-(3-fluoro-4-methylphenyl)-2-(4-{[(2-methoxyphenyl)carbamoyl]methyl}piperazin-1-yl)acetamide
K940-2779 Screening compound: N-(3-fluoro-4-methylphenyl)-2-(4-{[(2-methoxyphenyl)carbamoyl]methyl}piperazin-1-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K940-2779
N-(3-fluoro-4-methylphenyl)-2-(4-{[(2-methoxyphenyl)carbamoyl]methyl}piperazin-1-yl)acetamide

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

K940-2779

Molecular Formula

C22H27FN4O3 (C22 H27 FN4 O3)

Compound Name

N-(3-fluoro-4-methylphenyl)-2-(4-{[(2-methoxyphenyl)carbamoyl]methyl}piperazin-1-yl)acetamide

IUPAC name

N-(3-fluoro-4-methylphenyl)-2-(4-{[(2-methoxyphenyl)carbamoyl]methyl}piperazin-1-yl)acetamide

SMILES

Cc(ccc(NC(CN1CCN(CC(Nc(cccc2)c2OC)=O)CC1)=O)c1)c1F

InChI

InChI=1S/C22H27FN4O3/c1-16-7-8-17(13-18(16)23)24-21(28)14-26-9-11-27(12-10-26)15-22(29)25-19-5-3-4-6-20(19)30-2/h3-8,13H,9-12,14-15H2,1-2H3,(H,24,28)(H,25,29)

InChI Key

GSMLCCASSIDBQX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15115263

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

414.48

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.470

Distribution Coefficient, logD

3.469

Water Solubility, LogSw

-3.57

Polar Surface Area

60.743

Acid Dissociation Constant (pKa)

10.58

Base Dissociation Constant (pKb)

4.38

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.40

K940-2779 in Drug Discovery

Included in Screening Libraries

CNS targets activity set (6557 compounds)

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
Targets:
  • GPCR
  • Ion Channels

References: we are preparing a list of scientific research reports with K940-2779 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K940-2779?
Check Price and Availability of K940-2779, 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 K940-2779 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K940-2779
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K940-2779
  • 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 K940-2779 available by request