8006-5065 Screening compound: bis({[2-(butylsulfanyl)ethyl]sulfanyl})-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

8006-5065 Screening compound: bis({[2-(butylsulfanyl)ethyl]sulfanyl})-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
8006-5065 Screening compound: bis({[2-(butylsulfanyl)ethyl]sulfanyl})-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 8006-5065
bis({[2-(butylsulfanyl)ethyl]sulfanyl})-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

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

8006-5065

Molecular Formula

C15H26N4S5 (C15 H26 N4 S5)

Compound Name

bis({[2-(butylsulfanyl)ethyl]sulfanyl})-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

IUPAC name

bis({[2-(butylsulfanyl)ethyl]sulfanyl})-[124]triazolo[34-b][134]thiadiazole

SMILES

CCCCSCCSc1nnc2sc(SCCSCCCC)nn12

InChI

InChI=1S/C15H26N4S5/c1-3-5-7-20-9-11-22-13-16-17-14-19(13)18-15(24-14)23-12-10-21-8-6-4-2/h3-12H2,1-2H3

InChI Key

HXLGPYAMINJICM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00825463

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

422.73

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

14.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.157

Distribution Coefficient, logD

5.157

Water Solubility, LogSw

-5.00

Polar Surface Area

34.208

Acid Dissociation Constant (pKa)

25.57

Base Dissociation Constant (pKb)

2.21

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

80.00

References: we are preparing a list of scientific research reports with 8006-5065 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8006-5065?
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What is the minimum amount of 8006-5065 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8006-5065
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8006-5065
  • 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 8006-5065 available by request