Screening compound: ITCNYKNQDJUFSB-UHFFFAOYSA-N

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

Chemical Structure Depiction of ChemDiv screening compound
ITCNYKNQDJUFSB-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

G856-2606

Molecular Formula

C21H19ClN4O2S (C21 H19 ClN4 O2 S)

Compound Name

1-(4-chlorophenyl)-2-{[5-(1H-indol-3-yl)-4-(2-methoxyethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethan-1-one

IUPAC name

1-(4-chlorophenyl)-2-{[5-(1H-indol-3-yl)-4-(2-methoxyethyl)-4H-124-triazol-3-yl]sulfanyl}ethan-1-one

SMILES

COCCn1c(SCC(c(cc2)ccc2Cl)=O)nnc1-c1c[nH]c2c1cccc2

InChI

InChI=1S/C21H19ClN4O2S/c1-28-11-10-26-20(17-12-23-18-5-3-2-4-16(17)18)24-25-21(26)29-13-19(27)14-6-8-15(22)9-7-14/h2-9,12,23H,10-11,13H2,1H3

InChI Key

ITCNYKNQDJUFSB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04470031

ITCNYKNQDJUFSB-UHFFFAOYSA-N in Drug Discovery

Included in Screening Libraries

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

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
Structure:
  • Mimetics
Agro:
  • Agro

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

Frequently Asked Questions

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