Screening compound: FIBBUXANYKOBOP-UHFFFAOYSA-N

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

Chemical Structure Depiction of ChemDiv screening compound
FIBBUXANYKOBOP-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

8015-0887

Molecular Formula

C26H23N3O3S (C26 H23 N3 O3 S)

Compound Name

2-[(2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}phenyl)sulfanyl]benzonitrile

IUPAC name

2-[(2-{4-[(2H-13-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}phenyl)sulfanyl]benzonitrile

SMILES

N#Cc(cccc1)c1Sc(cccc1)c1C(N1CCN(Cc(cc2)cc3c2OCO3)CC1)=O

InChI

InChI=1S/C26H23N3O3S/c27-16-20-5-1-3-7-24(20)33-25-8-4-2-6-21(25)26(30)29-13-11-28(12-14-29)17-19-9-10-22-23(15-19)32-18-31-22/h1-10,15H,11-14,17-18H2

InChI Key

FIBBUXANYKOBOP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03855385

FIBBUXANYKOBOP-UHFFFAOYSA-N in Drug Discovery

Included in Screening Libraries

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

Serine Proteases Inhibitors Library (32732 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Proteases

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

Frequently Asked Questions

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