Screening compound: VKCIJBUPSKCIRD-QWHCGFSZSA-N

Screening compound: VKCIJBUPSKCIRD-QWHCGFSZSA-N
Screening compound: VKCIJBUPSKCIRD-QWHCGFSZSA-N alternative view

Chemical Structure Depiction of ChemDiv screening compound
VKCIJBUPSKCIRD-QWHCGFSZSA-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

S831-3529

Molecular Formula

C17H18N4O3S2 (C17 H18 N4 O3 S2)

Compound Name

4-{[3-(methoxymethyl)-4-(pyridin-2-yl)pyrrolidin-1-yl]sulfonyl}-2,1,3-benzothiadiazole

IUPAC name

4-{[(3S4S)-3-(methoxymethyl)-4-(pyridin-2-yl)pyrrolidin-1-yl]sulfonyl}-213-benzothiadiazole

SMILES

COC[C@@H](CN(C1)S(c2cccc3nsnc23)(=O)=O)[C@H]1c1ncccc1

InChI

InChI=1S/C17H18N4O3S2/c1-24-11-12-9-21(10-13(12)14-5-2-3-8-18-14)26(22,23)16-7-4-6-15-17(16)20-25-19-15/h2-8,12-13H,9-11H2,1H3/t12-,13+/m0/s1

InChI Key

VKCIJBUPSKCIRD-QWHCGFSZSA-N

MDL Number (MFCD)

VKCIJBUPSKCIRD-QWHCGFSZSA-N in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

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

KRAS-Targeted Library (16000 compounds)

PPI Helix Turn 3D-Mimetics Library (71298 compounds)

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
Targets:
  • Kinases
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Cyclic compounds

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

Frequently Asked Questions

How to purchase chemical compound VKCIJBUPSKCIRD-QWHCGFSZSA-N?
Check Price and Availability of VKCIJBUPSKCIRD-QWHCGFSZSA-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 VKCIJBUPSKCIRD-QWHCGFSZSA-N you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for VKCIJBUPSKCIRD-QWHCGFSZSA-N
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for VKCIJBUPSKCIRD-QWHCGFSZSA-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 VKCIJBUPSKCIRD-QWHCGFSZSA-N available by request