8017-7505 Screening compound: 3,4-bis(2-thienylcarbonyl)-1,2,5-oxadiazol-5-ium-5-olate

8017-7505 Screening compound: 3,4-bis(2-thienylcarbonyl)-1,2,5-oxadiazol-5-ium-5-olate
8017-7505 Screening compound: 3,4-bis(2-thienylcarbonyl)-1,2,5-oxadiazol-5-ium-5-olate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8017-7505
3,4-bis(2-thienylcarbonyl)-1,2,5-oxadiazol-5-ium-5-olate

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

8017-7505

Molecular Formula

C12H6N2O4S2 (C12 H6 N2 O4 S2)

Compound Name

3,4-bis(2-thienylcarbonyl)-1,2,5-oxadiazol-5-ium-5-olate

IUPAC name

bis(thiophene-2-carbonyl)-125-oxadiazol-2-ium-2-olate

SMILES

[O-][n+]1c(C(c2cccs2)=O)c(C(c2cccs2)=O)no1

InChI

InChI=1S/C12H6N2O4S2/c15-11(7-3-1-5-19-7)9-10(14(17)18-13-9)12(16)8-4-2-6-20-8/h1-6H

InChI Key

RUQGCDMXFBOTMW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00087397

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

306.32

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.932

Distribution Coefficient, logD

2.932

Water Solubility, LogSw

-3.21

Polar Surface Area

70.241

Acid Dissociation Constant (pKa)

14.00

Base Dissociation Constant (pKb)

-16.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

8017-7505 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

Human Kinases Annotated Library (2415 compounds)

Human Phosphatases Annotated Library (206 compounds)

Human Receptors Annotated Library (5376 compounds)

Opportunistic Pathogens of Immunocompromised Hosts Annotated Library (1773 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with 8017-7505 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8017-7505?
Check Price and Availability of 8017-7505, 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 8017-7505 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8017-7505
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8017-7505
  • 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 8017-7505 available by request