P909-5077 Screening compound: 3-{5-[1-(2,5-dimethylbenzoyl)-4-methylpyrrolidin-3-yl]-1,2,4-oxadiazol-3-yl}pyridine

P909-5077 Screening compound: 3-{5-[1-(2,5-dimethylbenzoyl)-4-methylpyrrolidin-3-yl]-1,2,4-oxadiazol-3-yl}pyridine
P909-5077 Screening compound: 3-{5-[1-(2,5-dimethylbenzoyl)-4-methylpyrrolidin-3-yl]-1,2,4-oxadiazol-3-yl}pyridine alternative view

Chemical Structure Depiction of ChemDiv screening compound P909-5077
3-{5-[1-(2,5-dimethylbenzoyl)-4-methylpyrrolidin-3-yl]-1,2,4-oxadiazol-3-yl}pyridine

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

P909-5077

Molecular Formula

C21H22N4O2 (C21 H22 N4 O2)

Compound Name

3-{5-[1-(2,5-dimethylbenzoyl)-4-methylpyrrolidin-3-yl]-1,2,4-oxadiazol-3-yl}pyridine

IUPAC name

3-{5-[(3R4R)-1-(25-dimethylbenzoyl)-4-methylpyrrolidin-3-yl]-124-oxadiazol-3-yl}pyridine

SMILES

C[C@@H](CN(C1)C(c2c(C)ccc(C)c2)=O)[C@H]1c1nc(-c2cnccc2)no1

InChI

InChI=1S/C21H22N4O2/c1-13-6-7-14(2)17(9-13)21(26)25-11-15(3)18(12-25)20-23-19(24-27-20)16-5-4-8-22-10-16/h4-10,15,18H,11-12H2,1-3H3/t15-,18-/m1/s1

InChI Key

FXMNDIRZXQQTHX-CRAIPNDOSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

362.43

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.706

Distribution Coefficient, logD

3.068

Water Solubility, LogSw

-3.71

Polar Surface Area

58.043

Acid Dissociation Constant (pKa)

24.32

Base Dissociation Constant (pKb)

7.93

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

33.30

P909-5077 in Drug Discovery

Included in Screening Libraries

Bcl2-PPI Inhibitors Library (12246 compounds)

CNS Targets (44014 compounds)

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

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Inhibitors of beta-Catenin Signaling (7445 compounds)

MDM2-p53 interaction inhibitors Library (21687 compounds)

Peptidomimetics of Beta-Turn Motifs Library (2153 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Hemic and lymphatic
  • Nervous system
  • Cancer
Mechanism of action:
  • PPI modulators
  • PPI modulators
  • PPI modulators
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Cyclic compounds
  • Mimetics

References: we are preparing a list of scientific research reports with P909-5077 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P909-5077?
Check Price and Availability of P909-5077, 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 P909-5077 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P909-5077
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P909-5077
  • 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 P909-5077 available by request