Screening compound: MFCD22598694

Screening compound: MFCD22598694
Screening compound: MFCD22598694 alternative view

Chemical Structure Depiction of ChemDiv screening compound
MFCD22598694

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

P803-0492

Molecular Formula

C20H20N4O3S (C20 H20 N4 O3 S)

Compound Name

{4-[3-(1,3-benzodioxol-5-yl)-1H-pyrazol-5-yl]-1,4-diazepan-1-yl}(2-thienyl)methanone

IUPAC name

1-[3-(2H-13-benzodioxol-5-yl)-1H-pyrazol-5-yl]-4-(thiophene-2-carbonyl)-14-diazepane

SMILES

O=C(c1cccs1)N(CCC1)CCN1c1cc(-c(cc2)cc3c2OCO3)n[nH]1

InChI

InChI=1S/C20H20N4O3S/c25-20(18-3-1-10-28-18)24-7-2-6-23(8-9-24)19-12-15(21-22-19)14-4-5-16-17(11-14)27-13-26-16/h1,3-5,10-12H,2,6-9,13H2,(H,21,22)

InChI Key

KARGJBBQAHFVLX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD22598694

MFCD22598694 in Drug Discovery

Included in Screening Libraries

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

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

Protein-Protein Interaction Library (218420 compounds)

Recognition Elements PPI Library (24135 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Mimetics

References: we are preparing a list of scientific research reports with MFCD22598694 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound MFCD22598694?
Check Price and Availability of MFCD22598694, 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 MFCD22598694 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for MFCD22598694
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for MFCD22598694
  • 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 MFCD22598694 available by request