Screening compound: ATEUHXLEZSEITB-UHFFFAOYSA-N

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

Chemical Structure Depiction of ChemDiv screening compound
ATEUHXLEZSEITB-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

8015-0516

Molecular Formula

C22H21N5O3S (C22 H21 N5 O3 S)

Compound Name

methyl 4-(2-{[5-(propan-2-yl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]sulfanyl}acetamido)benzoate

IUPAC name

methyl 4-(2-{[5-(propan-2-yl)-5H-[124]triazino[56-b]indol-3-yl]sulfanyl}acetamido)benzoate

SMILES

CC(C)n1c2nc(SCC(Nc(cc3)ccc3C(OC)=O)=O)nnc2c2c1cccc2

InChI

InChI=1S/C22H21N5O3S/c1-13(2)27-17-7-5-4-6-16(17)19-20(27)24-22(26-25-19)31-12-18(28)23-15-10-8-14(9-11-15)21(29)30-3/h4-11,13H,12H2,1-3H3,(H,23,28)

InChI Key

ATEUHXLEZSEITB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01891211

ATEUHXLEZSEITB-UHFFFAOYSA-N in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Anticancer Library (62698 compounds)

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

SH2 Library (10483 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer
  • Cancer
  • Endocrine
Mechanism of action:
  • PPI modulators

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

Frequently Asked Questions

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