Screening compound: DOQODKNKUBKAGI-UHFFFAOYSA-N

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

Chemical Structure Depiction of ChemDiv screening compound
DOQODKNKUBKAGI-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

G856-1328

Molecular Formula

C23H15F3N4O2S (C23 H15 F3 N4 O2 S)

Compound Name

2-{[(pyridin-3-yl)methyl]sulfanyl}-3-[4-(trifluoromethoxy)phenyl]-3H,4H,5H-pyrimido[5,4-b]indol-4-one

IUPAC name

2-{[(pyridin-3-yl)methyl]sulfanyl}-3-[4-(trifluoromethoxy)phenyl]-3H4H5H-pyrimido[54-b]indol-4-one

SMILES

O=C1N(c(cc2)ccc2OC(F)(F)F)C(SCc2cnccc2)=Nc2c1[nH]c1c2cccc1

InChI

InChI=1S/C23H15F3N4O2S/c24-23(25,26)32-16-9-7-15(8-10-16)30-21(31)20-19(17-5-1-2-6-18(17)28-20)29-22(30)33-13-14-4-3-11-27-12-14/h1-12,28H,13H2

InChI Key

DOQODKNKUBKAGI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05951435

DOQODKNKUBKAGI-UHFFFAOYSA-N in Drug Discovery

Included in Screening Libraries

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

CNS Targets (44014 compounds)

Cysteine Proteases Inhibitors Library (7839 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • 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 DOQODKNKUBKAGI-UHFFFAOYSA-N chemical compound. It will be published here after verification.

Frequently Asked Questions

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