Screening compound: JJYLSXUHDFUCGU-UHFFFAOYSA-N

Screening compound: JJYLSXUHDFUCGU-UHFFFAOYSA-N
Screening compound: JJYLSXUHDFUCGU-UHFFFAOYSA-N alternative view

Chemical Structure Depiction of ChemDiv screening compound
JJYLSXUHDFUCGU-UHFFFAOYSA-N

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

4311-1814

Molecular Formula

C13H12N2O4S4 (C13 H12 N2 O4 S4)

Compound Name

3-{2-[(5Z)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-2,3-dihydro-1,3-benzothiazol-3-yl}propane-1-sulfonic acid

IUPAC name

3-{2-[(5Z)-4-oxo-2-sulfanylidene-13-thiazolidin-5-ylidene]-23-dihydro-13-benzothiazol-3-yl}propane-1-sulfonic acid

SMILES

OS(CCCN(c(cccc1)c1S1)/C1=C(\C(N1)=O)/SC1=S)(=O)=O

InChI

InChI=1S/C13H12N2O4S4/c16-11-10(22-13(20)14-11)12-15(6-3-7-23(17,18)19)8-4-1-2-5-9(8)21-12/h1-2,4-5H,3,6-7H2,(H,14,16,20)(H,17,18,19)

InChI Key

JJYLSXUHDFUCGU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02222798

JJYLSXUHDFUCGU-UHFFFAOYSA-N in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Covalent Inhibitors Library (7986 compounds)

Included in 1.7M Stock Database

Structure:
  • Cyclic compounds
  • 3D
  • Fragments

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

Frequently Asked Questions

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