Screening compound: CIUUBAHIGRGVLP-UHFFFAOYSA-N

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

Chemical Structure Depiction of ChemDiv screening compound
CIUUBAHIGRGVLP-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

G864-0218

Molecular Formula

C22H17F3N4O2S (C22 H17 F3 N4 O2 S)

Compound Name

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

IUPAC name

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

SMILES

C=CCN(C1=O)C(SCC(Nc2cc(C(F)(F)F)ccc2)=O)=Nc2c1[nH]c1c2cccc1

InChI

InChI=1S/C22H17F3N4O2S/c1-2-10-29-20(31)19-18(15-8-3-4-9-16(15)27-19)28-21(29)32-12-17(30)26-14-7-5-6-13(11-14)22(23,24)25/h2-9,11,27H,1,10,12H2,(H,26,30)

InChI Key

CIUUBAHIGRGVLP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05952441

CIUUBAHIGRGVLP-UHFFFAOYSA-N in Drug Discovery

Included in Screening Libraries

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

Cysteine Proteases Inhibitors Library (7839 compounds)

Included in 1.7M Stock Database

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 CIUUBAHIGRGVLP-UHFFFAOYSA-N chemical compound. It will be published here after verification.

Frequently Asked Questions

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