Screening compound: NJSMIBPSWNKKPB-UHFFFAOYSA-N

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

Chemical Structure Depiction of ChemDiv screening compound
NJSMIBPSWNKKPB-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

C433-0556

Molecular Formula

C17H11F3N4O2 (C17 H11 F3 N4 O2)

Compound Name

5-(3,4-difluorophenyl)-1-[(3-fluorophenyl)methyl]-1H,3aH,4H,5H,6H,6aH-pyrrolo[3,4-d][1,2,3]triazole-4,6-dione

IUPAC name

5-(34-difluorophenyl)-1-[(3-fluorophenyl)methyl]-1H3aH4H5H6H6aH-pyrrolo[34-d][123]triazole-46-dione

SMILES

O=C(C1N(Cc2cc(F)ccc2)N=NC1C1=O)N1c(cc1)cc(F)c1F

InChI

InChI=1S/C17H11F3N4O2/c18-10-3-1-2-9(6-10)8-23-15-14(21-22-23)16(25)24(17(15)26)11-4-5-12(19)13(20)7-11/h1-7,14-15H,8H2

InChI Key

NJSMIBPSWNKKPB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14757279

NJSMIBPSWNKKPB-UHFFFAOYSA-N in Drug Discovery

Included in Screening Libraries

Cysteine Proteases Inhibitors Library (7839 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 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 NJSMIBPSWNKKPB-UHFFFAOYSA-N chemical compound. It will be published here after verification.

Frequently Asked Questions

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