K242-1097 Screening compound: 2-{[4-(2H-1,3-benzodioxol-5-yl)-1-phenyl-1H-imidazol-2-yl]sulfanyl}-N-(3-chlorophenyl)acetamide

K242-1097 Screening compound: 2-{[4-(2H-1,3-benzodioxol-5-yl)-1-phenyl-1H-imidazol-2-yl]sulfanyl}-N-(3-chlorophenyl)acetamide
K242-1097 Screening compound: 2-{[4-(2H-1,3-benzodioxol-5-yl)-1-phenyl-1H-imidazol-2-yl]sulfanyl}-N-(3-chlorophenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K242-1097
2-{[4-(2H-1,3-benzodioxol-5-yl)-1-phenyl-1H-imidazol-2-yl]sulfanyl}-N-(3-chlorophenyl)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

K242-1097

Molecular Formula

C24H18ClN3O3S (C24 H18 ClN3 O3 S)

Compound Name

2-{[4-(2H-1,3-benzodioxol-5-yl)-1-phenyl-1H-imidazol-2-yl]sulfanyl}-N-(3-chlorophenyl)acetamide

IUPAC name

2-{[4-(2H-13-benzodioxol-5-yl)-1-phenyl-1H-imidazol-2-yl]sulfanyl}-N-(3-chlorophenyl)acetamide

SMILES

O=C(CSc1nc(-c(cc2)cc3c2OCO3)cn1-c1ccccc1)Nc1cccc(Cl)c1

InChI

InChI=1S/C24H18ClN3O3S/c25-17-5-4-6-18(12-17)26-23(29)14-32-24-27-20(13-28(24)19-7-2-1-3-8-19)16-9-10-21-22(11-16)31-15-30-21/h1-13H,14-15H2,(H,26,29)

InChI Key

IYJVCTSMVPMOFO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15083650

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

463.94

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.140

Distribution Coefficient, logD

6.139

Water Solubility, LogSw

-6.27

Polar Surface Area

51.972

Acid Dissociation Constant (pKa)

11.04

Base Dissociation Constant (pKb)

4.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.30

K242-1097 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with K242-1097 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K242-1097?
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What is the minimum amount of K242-1097 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K242-1097
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K242-1097
  • 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 K242-1097 available by request