Screening compound: PBKDJIIVYIRHQQ-UHFFFAOYSA-N

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

Chemical Structure Depiction of ChemDiv screening compound
PBKDJIIVYIRHQQ-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

G499-0301

Molecular Formula

C22H23FN2O6S (C22 H23 FN2 O6 S)

Compound Name

8-(2H-1,3-benzodioxole-5-carbonyl)-4-(4-fluoro-3-methylbenzenesulfonyl)-1-oxa-4,8-diazaspiro[4.5]decane

IUPAC name

8-(2H-13-benzodioxole-5-carbonyl)-4-(4-fluoro-3-methylbenzenesulfonyl)-1-oxa-48-diazaspiro[4.5]decane

SMILES

Cc(cc(cc1)S(N2C(CC3)(CCN3C(c(cc3)cc4c3OCO4)=O)OCC2)(=O)=O)c1F

InChI

InChI=1S/C22H23FN2O6S/c1-15-12-17(3-4-18(15)23)32(27,28)25-10-11-31-22(25)6-8-24(9-7-22)21(26)16-2-5-19-20(13-16)30-14-29-19/h2-5,12-13H,6-11,14H2,1H3

InChI Key

PBKDJIIVYIRHQQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09235645

PBKDJIIVYIRHQQ-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)

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

Frequently Asked Questions

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