Screening compound: XQNCETRQFQQIMP-UHFFFAOYSA-N

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

Chemical Structure Depiction of ChemDiv screening compound
XQNCETRQFQQIMP-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

6528-0395

Molecular Formula

C31H33N3O6 (C31 H33 N3 O6)

Compound Name

4'-hydroxy-3'-(2-methyl-2,3-dihydro-1-benzofuran-5-carbonyl)-1'-[3-(morpholin-4-yl)propyl]-1-(prop-2-en-1-yl)-1,1',2,5'-tetrahydrospiro[indole-3,2'-pyrrole]-2,5'-dione

IUPAC name

4'-hydroxy-3'-(2-methyl-23-dihydro-1-benzofuran-5-carbonyl)-1'-[3-(morpholin-4-yl)propyl]-1-(prop-2-en-1-yl)-11'25'-tetrahydrospiro[indole-32'-pyrrole]-25'-dione

SMILES

CC(C1)Oc(cc2)c1cc2C(C(C(c(cccc1)c1N1CC=C)(C1=O)N(CCCN1CCOCC1)C1=O)=C1O)=O

InChI

InChI=1S/C31H33N3O6/c1-3-11-33-24-8-5-4-7-23(24)31(30(33)38)26(27(35)21-9-10-25-22(19-21)18-20(2)40-25)28(36)29(37)34(31)13-6-12-32-14-16-39-17-15-32/h3-5,7-10,19-20,36H,1,6,11-18H2,2H3

InChI Key

XQNCETRQFQQIMP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04446830

XQNCETRQFQQIMP-UHFFFAOYSA-N in Drug Discovery

Included in Screening Libraries

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

Protein-Protein Interaction Library (218420 compounds)

Spiro Library (21655 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds
  • Cyclic compounds

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

Frequently Asked Questions

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