8019-9343 Screening compound: 4-{[5-(furan-3-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}oxolan-2-one

8019-9343 Screening compound: 4-{[5-(furan-3-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}oxolan-2-one
8019-9343 Screening compound: 4-{[5-(furan-3-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}oxolan-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 8019-9343
4-{[5-(furan-3-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}oxolan-2-one

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

8019-9343

Molecular Formula

C11H11N3O3S (C11 H11 N3 O3 S)

Compound Name

4-{[5-(furan-3-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}oxolan-2-one

IUPAC name

4-{[5-(furan-3-yl)-4-methyl-4H-124-triazol-3-yl]sulfanyl}oxolan-2-one

SMILES

Cn1c(SC(C2)COC2=O)nnc1-c1cocc1

InChI

InChI=1S/C11H11N3O3S/c1-14-10(7-2-3-16-5-7)12-13-11(14)18-8-4-9(15)17-6-8/h2-3,5,8H,4,6H2,1H3/t8-/m0/s1

InChI Key

RFADSEGICRRZET-QMMMGPOBSA-N

MDL Number (MFCD)

MFCD12034285

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

265.29

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.205

Distribution Coefficient, logD

1.205

Water Solubility, LogSw

-2.09

Polar Surface Area

55.184

Acid Dissociation Constant (pKa)

16.42

Base Dissociation Constant (pKb)

1.66

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

36.36

8019-9343 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Antiparasite Library (23996 compounds)

Fragments Library (11262 compounds)

Soluble Diversity Library (15920 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro
Structure:
  • Fragments

References: we are preparing a list of scientific research reports with 8019-9343 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8019-9343?
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What is the minimum amount of 8019-9343 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8019-9343
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8019-9343
  • 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 8019-9343 available by request