K940-1158 Screening compound: N-(4-{2-[4-(4-chlorophenyl)piperazin-1-yl]acetamido}-2,5-dimethoxyphenyl)benzamide

K940-1158 Screening compound: N-(4-{2-[4-(4-chlorophenyl)piperazin-1-yl]acetamido}-2,5-dimethoxyphenyl)benzamide
K940-1158 Screening compound: N-(4-{2-[4-(4-chlorophenyl)piperazin-1-yl]acetamido}-2,5-dimethoxyphenyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K940-1158
N-(4-{2-[4-(4-chlorophenyl)piperazin-1-yl]acetamido}-2,5-dimethoxyphenyl)benzamide

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

K940-1158

Molecular Formula

C27H29ClN4O4 (C27 H29 ClN4 O4)

Compound Name

N-(4-{2-[4-(4-chlorophenyl)piperazin-1-yl]acetamido}-2,5-dimethoxyphenyl)benzamide

IUPAC name

N-(4-{2-[4-(4-chlorophenyl)piperazin-1-yl]acetamido}-25-dimethoxyphenyl)benzamide

SMILES

COc(cc(c(OC)c1)NC(c2ccccc2)=O)c1NC(CN(CC1)CCN1c(cc1)ccc1Cl)=O

InChI

InChI=1S/C27H29ClN4O4/c1-35-24-17-23(30-27(34)19-6-4-3-5-7-19)25(36-2)16-22(24)29-26(33)18-31-12-14-32(15-13-31)21-10-8-20(28)9-11-21/h3-11,16-17H,12-15,18H2,1-2H3,(H,29,33)(H,30,34)

InChI Key

KMIUGRPBFMYHCQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15115097

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

509

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.617

Distribution Coefficient, logD

4.594

Water Solubility, LogSw

-4.79

Polar Surface Area

67.337

Acid Dissociation Constant (pKa)

8.68

Base Dissociation Constant (pKb)

3.98

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.90

K940-1158 in Drug Discovery

Included in Screening Libraries

Neurotransmitter Transporter Inhibitors Library (11024 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 K940-1158 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K940-1158?
Check Price and Availability of K940-1158, 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 K940-1158 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K940-1158
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K940-1158
  • 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 K940-1158 available by request