Screening compound: MFCD31957322

Screening compound: MFCD31957322
Screening compound: MFCD31957322 alternative view

Chemical Structure Depiction of ChemDiv screening compound
MFCD31957322

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

S897-0880

Molecular Formula

C25H39N3O3 (C25 H39 N3 O3)

Compound Name

3-cyclohexyl-1-(4-{[2-(propan-2-yl)-5H,6H,8H,9H-oxepino[4,5-d]pyrimidin-4-yl]oxy}piperidin-1-yl)propan-1-one

IUPAC name

3-cyclohexyl-1-(4-{[2-(propan-2-yl)-5H6H8H9H-oxepino[45-d]pyrimidin-4-yl]oxy}piperidin-1-yl)propan-1-one

SMILES

CC(C)c1nc(CCOCC2)c2c(OC(CC2)CCN2C(CCC2CCCCC2)=O)n1

InChI

InChI=1S/C25H39N3O3/c1-18(2)24-26-22-13-17-30-16-12-21(22)25(27-24)31-20-10-14-28(15-11-20)23(29)9-8-19-6-4-3-5-7-19/h18-20H,3-17H2,1-2H3

InChI Key

HITBJIRIJXUCKE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD31957322

MFCD31957322 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

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

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

Protein-Protein Interaction Library (218420 compounds)

Alpha-Helix Mimetics Library (25899 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with MFCD31957322 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound MFCD31957322?
Check Price and Availability of MFCD31957322, 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 MFCD31957322 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for MFCD31957322
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for MFCD31957322
  • 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 MFCD31957322 available by request