K940-1818 Screening compound: N-[4-(diethylamino)phenyl]-2-(4-{[(4-methoxyphenyl)carbamoyl]methyl}piperazin-1-yl)acetamide

K940-1818 Screening compound: N-[4-(diethylamino)phenyl]-2-(4-{[(4-methoxyphenyl)carbamoyl]methyl}piperazin-1-yl)acetamide
K940-1818 Screening compound: N-[4-(diethylamino)phenyl]-2-(4-{[(4-methoxyphenyl)carbamoyl]methyl}piperazin-1-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K940-1818
N-[4-(diethylamino)phenyl]-2-(4-{[(4-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

K940-1818

Molecular Formula

C25H35N5O3 (C25 H35 N5 O3)

Compound Name

N-[4-(diethylamino)phenyl]-2-(4-{[(4-methoxyphenyl)carbamoyl]methyl}piperazin-1-yl)acetamide

IUPAC name

N-[4-(diethylamino)phenyl]-2-(4-{[(4-methoxyphenyl)carbamoyl]methyl}piperazin-1-yl)acetamide

SMILES

CCN(CC)c(cc1)ccc1NC(CN1CCN(CC(Nc(cc2)ccc2OC)=O)CC1)=O

InChI

InChI=1S/C25H35N5O3/c1-4-30(5-2)22-10-6-20(7-11-22)26-24(31)18-28-14-16-29(17-15-28)19-25(32)27-21-8-12-23(33-3)13-9-21/h6-13H,4-5,14-19H2,1-3H3,(H,26,31)(H,27,32)

InChI Key

TXGSMJJWQSYKPK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15115165

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

453.58

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.860

Distribution Coefficient, logD

3.668

Water Solubility, LogSw

-3.89

Polar Surface Area

64.090

Acid Dissociation Constant (pKa)

12.26

Base Dissociation Constant (pKb)

7.15

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

44.00

K940-1818 in Drug Discovery

Included in Screening Libraries

Dark Chemical Matter Library (18430 compounds)

Eccentric PPI Library (11937 compounds)

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Protein-Protein Interaction Library (218420 compounds)

Voltage-Gated Ion Channel-Targeted Library (4740 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool
  • Cyclic compounds
Mechanism of action:
  • PPI modulators
  • PPI modulators
Therapeutical areas:
  • Nervous system
  • Nervous system
Targets:
  • GPCR
  • Ion Channels
  • Ion Channels

References: we are preparing a list of scientific research reports with K940-1818 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K940-1818?
Check Price and Availability of K940-1818, 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 K940-1818 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K940-1818
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K940-1818
  • 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 K940-1818 available by request