Screening compound: KKIJDVUXILLZTH-UHFFFAOYSA-N

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

Chemical Structure Depiction of ChemDiv screening compound
KKIJDVUXILLZTH-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

G864-0212

Molecular Formula

C22H20N4O3S (C22 H20 N4 O3 S)

Compound Name

N-(4-methoxyphenyl)-2-{[4-oxo-3-(prop-2-en-1-yl)-3H,4H,5H-pyrimido[5,4-b]indol-2-yl]sulfanyl}acetamide

IUPAC name

N-(4-methoxyphenyl)-2-{[4-oxo-3-(prop-2-en-1-yl)-3H4H5H-pyrimido[54-b]indol-2-yl]sulfanyl}acetamide

SMILES

COc(cc1)ccc1NC(CSC(N(CC=C)C1=O)=Nc2c1[nH]c1c2cccc1)=O

InChI

InChI=1S/C22H20N4O3S/c1-3-12-26-21(28)20-19(16-6-4-5-7-17(16)24-20)25-22(26)30-13-18(27)23-14-8-10-15(29-2)11-9-14/h3-11,24H,1,12-13H2,2H3,(H,23,27)

InChI Key

KKIJDVUXILLZTH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05952432

KKIJDVUXILLZTH-UHFFFAOYSA-N in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Cysteine Proteases Inhibitors Library (7839 compounds)

Dark Chemical Matter Library (18430 compounds)

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

Included in 1.7M Stock Database

Structure:
  • 3D
  • Pool
Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Nervous system
  • Cardiovascular
  • Skin
  • Metabolic
  • Endocrine
  • Immune system
Targets:
  • Proteases

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

Frequently Asked Questions

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