K940-1901 Screening compound: N-(2H-1,3-benzodioxol-5-yl)-2-(4-{[(4-ethoxyphenyl)carbamoyl]methyl}piperazin-1-yl)acetamide

K940-1901 Screening compound: N-(2H-1,3-benzodioxol-5-yl)-2-(4-{[(4-ethoxyphenyl)carbamoyl]methyl}piperazin-1-yl)acetamide
K940-1901 Screening compound: N-(2H-1,3-benzodioxol-5-yl)-2-(4-{[(4-ethoxyphenyl)carbamoyl]methyl}piperazin-1-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K940-1901
N-(2H-1,3-benzodioxol-5-yl)-2-(4-{[(4-ethoxyphenyl)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

K940-1901

Molecular Formula

C23H28N4O5 (C23 H28 N4 O5)

Compound Name

N-(2H-1,3-benzodioxol-5-yl)-2-(4-{[(4-ethoxyphenyl)carbamoyl]methyl}piperazin-1-yl)acetamide

IUPAC name

N-(2H-13-benzodioxol-5-yl)-2-(4-{[(4-ethoxyphenyl)carbamoyl]methyl}piperazin-1-yl)acetamide

SMILES

CCOc(cc1)ccc1NC(CN1CCN(CC(Nc(cc2)cc3c2OCO3)=O)CC1)=O

InChI

InChI=1S/C23H28N4O5/c1-2-30-19-6-3-17(4-7-19)24-22(28)14-26-9-11-27(12-10-26)15-23(29)25-18-5-8-20-21(13-18)32-16-31-20/h3-8,13H,2,9-12,14-16H2,1H3,(H,24,28)(H,25,29)

InChI Key

HXTUAGHRPFUIHT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15115176

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

440.5

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.269

Distribution Coefficient, logD

3.269

Water Solubility, LogSw

-3.31

Polar Surface Area

78.049

Acid Dissociation Constant (pKa)

11.28

Base Dissociation Constant (pKb)

4.38

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

39.10

K940-1901 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Dark Chemical Matter Library (18430 compounds)

Voltage-Gated Ion Channel-Targeted Library (4740 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
  • Pool
Therapeutical areas:
  • Nervous system
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with K940-1901 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K940-1901?
Check Price and Availability of K940-1901, 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 K940-1901 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K940-1901
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K940-1901
  • 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 K940-1901 available by request