Screening compound: JKRUUSTVFUYLHV-UHFFFAOYSA-N

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

Chemical Structure Depiction of ChemDiv screening compound
JKRUUSTVFUYLHV-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

J031-2121

Molecular Formula

C21H21N3O4S (C21 H21 N3 O4 S)

Compound Name

2-{[5-(8-methoxy-3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-1-phenyl-1-ethanone

IUPAC name

n/a

SMILES

Cn1c(SCC(c2ccccc2)=O)nnc1-c(cc1OCCCOc1c1)c1OC

InChI

InChI=1S/C21H21N3O4S/c1-24-20(15-11-18-19(12-17(15)26-2)28-10-6-9-27-18)22-23-21(24)29-13-16(25)14-7-4-3-5-8-14/h3-5,7-8,11-12H,6,9-10,13H2,1-2H3

InChI Key

JKRUUSTVFUYLHV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27221201

JKRUUSTVFUYLHV-UHFFFAOYSA-N in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Anticancer Library (62698 compounds)

Protein-Protein Interaction Library (218420 compounds)

Recognition Elements PPI Library (24135 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Cancer
Targets:
  • Kinases
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

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

Frequently Asked Questions

How to purchase chemical compound JKRUUSTVFUYLHV-UHFFFAOYSA-N?
Check Price and Availability of JKRUUSTVFUYLHV-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 JKRUUSTVFUYLHV-UHFFFAOYSA-N you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for JKRUUSTVFUYLHV-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 JKRUUSTVFUYLHV-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 JKRUUSTVFUYLHV-UHFFFAOYSA-N available by request