K940-3700 Screening compound: 3-[4-(2,5-dichlorobenzenesulfonyl)piperazin-1-yl]-N-(4-methoxyphenyl)propanamide

K940-3700 Screening compound: 3-[4-(2,5-dichlorobenzenesulfonyl)piperazin-1-yl]-N-(4-methoxyphenyl)propanamide
K940-3700 Screening compound: 3-[4-(2,5-dichlorobenzenesulfonyl)piperazin-1-yl]-N-(4-methoxyphenyl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K940-3700
3-[4-(2,5-dichlorobenzenesulfonyl)piperazin-1-yl]-N-(4-methoxyphenyl)propanamide

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

K940-3700

Molecular Formula

C20H23Cl2N3O4S (C20 H23 Cl2 N3 O4 S)

Compound Name

3-[4-(2,5-dichlorobenzenesulfonyl)piperazin-1-yl]-N-(4-methoxyphenyl)propanamide

IUPAC name

3-[4-(25-dichlorobenzenesulfonyl)piperazin-1-yl]-N-(4-methoxyphenyl)propanamide

SMILES

COc(cc1)ccc1NC(CCN(CC1)CCN1S(c(cc(cc1)Cl)c1Cl)(=O)=O)=O

InChI

InChI=1S/C20H23Cl2N3O4S/c1-29-17-5-3-16(4-6-17)23-20(26)8-9-24-10-12-25(13-11-24)30(27,28)19-14-15(21)2-7-18(19)22/h2-7,14H,8-13H2,1H3,(H,23,26)

InChI Key

OTCZHYJBQMJYJT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15115323

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

472.39

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.027

Distribution Coefficient, logD

3.024

Water Solubility, LogSw

-3.60

Polar Surface Area

66.161

Acid Dissociation Constant (pKa)

12.39

Base Dissociation Constant (pKb)

5.23

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.00

K940-3700 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

CNS targets activity set (6557 compounds)

NOTUM (Wnt signaling) Library (3881 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 K940-3700 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K940-3700?
Check Price and Availability of K940-3700, 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 K940-3700 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K940-3700
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K940-3700
  • 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 K940-3700 available by request