6734-1241 Screening compound: 3-(4-methylphenyl)-5-[({4-phenyl-5-[(thiophen-2-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]-1,2,4-oxadiazole

6734-1241 Screening compound: 3-(4-methylphenyl)-5-[({4-phenyl-5-[(thiophen-2-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]-1,2,4-oxadiazole
6734-1241 Screening compound: 3-(4-methylphenyl)-5-[({4-phenyl-5-[(thiophen-2-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]-1,2,4-oxadiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 6734-1241
3-(4-methylphenyl)-5-[({4-phenyl-5-[(thiophen-2-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]-1,2,4-oxadiazole

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

6734-1241

Molecular Formula

C23H19N5OS2 (C23 H19 N5 OS2)

Compound Name

3-(4-methylphenyl)-5-[({4-phenyl-5-[(thiophen-2-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]-1,2,4-oxadiazole

IUPAC name

3-(4-methylphenyl)-5-[({4-phenyl-5-[(thiophen-2-yl)methyl]-4H-124-triazol-3-yl}sulfanyl)methyl]-124-oxadiazole

SMILES

Cc(cc1)ccc1-c1noc(CSc2nnc(Cc3cccs3)n2-c2ccccc2)n1

InChI

InChI=1S/C23H19N5OS2/c1-16-9-11-17(12-10-16)22-24-21(29-27-22)15-31-23-26-25-20(14-19-8-5-13-30-19)28(23)18-6-3-2-4-7-18/h2-13H,14-15H2,1H3

InChI Key

JHWUVRXRNDHYLU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05131008

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

445.57

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.476

Distribution Coefficient, logD

5.476

Water Solubility, LogSw

-5.66

Polar Surface Area

58.050

Acid Dissociation Constant (pKa)

26.55

Base Dissociation Constant (pKb)

5.06

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.00

6734-1241 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

CNS targets activity set (6557 compounds)

Human Ion Channels Annotated Library (353 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 6734-1241 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6734-1241?
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What is the minimum amount of 6734-1241 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6734-1241
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6734-1241
  • 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 6734-1241 available by request