P767-0223 Screening compound: 4-(3-{1-[2-(pyrrolidin-1-yl)ethyl]-1H-1,3-benzodiazol-5-yl}-1,2,4-oxadiazol-5-yl)benzonitrile

P767-0223 Screening compound: 4-(3-{1-[2-(pyrrolidin-1-yl)ethyl]-1H-1,3-benzodiazol-5-yl}-1,2,4-oxadiazol-5-yl)benzonitrile
P767-0223 Screening compound: 4-(3-{1-[2-(pyrrolidin-1-yl)ethyl]-1H-1,3-benzodiazol-5-yl}-1,2,4-oxadiazol-5-yl)benzonitrile alternative view

Chemical Structure Depiction of ChemDiv screening compound P767-0223
4-(3-{1-[2-(pyrrolidin-1-yl)ethyl]-1H-1,3-benzodiazol-5-yl}-1,2,4-oxadiazol-5-yl)benzonitrile

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

P767-0223

Molecular Formula

C22H20N6O (C22 H20 N6 O)

Compound Name

4-(3-{1-[2-(pyrrolidin-1-yl)ethyl]-1H-1,3-benzodiazol-5-yl}-1,2,4-oxadiazol-5-yl)benzonitrile

IUPAC name

4-(3-{1-[2-(pyrrolidin-1-yl)ethyl]-1H-13-benzodiazol-5-yl}-124-oxadiazol-5-yl)benzonitrile

SMILES

N#Cc(cc1)ccc1-c1nc(-c(cc2)cc3c2n(CCN2CCCC2)cn3)no1

InChI

InChI=1S/C22H20N6O/c23-14-16-3-5-17(6-4-16)22-25-21(26-29-22)18-7-8-20-19(13-18)24-15-28(20)12-11-27-9-1-2-10-27/h3-8,13,15H,1-2,9-12H2

InChI Key

FEVKZHVMTNDZLV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27614609

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

384.44

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.460

Distribution Coefficient, logD

2.439

Water Solubility, LogSw

-3.59

Polar Surface Area

63.212

Acid Dissociation Constant (pKa)

24.52

Base Dissociation Constant (pKb)

8.38

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

P767-0223 in Drug Discovery

Included in Screening Libraries

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

CNS Targets (44014 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with P767-0223 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P767-0223?
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What is the minimum amount of P767-0223 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P767-0223
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P767-0223
  • 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 P767-0223 available by request