C301-8704 Screening compound: 1-[(4-bromophenyl)(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]-4-(pyridin-2-yl)piperazine

C301-8704 Screening compound: 1-[(4-bromophenyl)(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]-4-(pyridin-2-yl)piperazine
C301-8704 Screening compound: 1-[(4-bromophenyl)(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]-4-(pyridin-2-yl)piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound C301-8704
1-[(4-bromophenyl)(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]-4-(pyridin-2-yl)piperazine

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

C301-8704

Molecular Formula

C24H22BrN5O (C24 H22 BrN5 O)

Compound Name

1-[(4-bromophenyl)(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]-4-(pyridin-2-yl)piperazine

IUPAC name

1-[(4-bromophenyl)(5-phenyl-134-oxadiazol-2-yl)methyl]-4-(pyridin-2-yl)piperazine

SMILES

Brc1ccc(C(c2nnc(-c3ccccc3)o2)N(CC2)CCN2c2ncccc2)cc1

InChI

InChI=1S/C24H22BrN5O/c25-20-11-9-18(10-12-20)22(24-28-27-23(31-24)19-6-2-1-3-7-19)30-16-14-29(15-17-30)21-8-4-5-13-26-21/h1-13,22H,14-17H2/t22-/m1/s1

InChI Key

BWDUYQKYNKQIKN-JOCHJYFZSA-N

MDL Number (MFCD)

MFCD14745601

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

476.38

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.416

Distribution Coefficient, logD

5.396

Water Solubility, LogSw

-5.84

Polar Surface Area

45.279

Acid Dissociation Constant (pKa)

24.28

Base Dissociation Constant (pKb)

6.09

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

20.80

C301-8704 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

DGK Inhibitors Library (10558 compounds)

SmartTM Library (51161 compounds)

Targeted Diversity Library (40567 compounds)

Epigenetics Focused Set (26518 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Kinases
Agro:
  • Agro

References: we are preparing a list of scientific research reports with C301-8704 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C301-8704?
Check Price and Availability of C301-8704, 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 C301-8704 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C301-8704
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C301-8704
  • 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 C301-8704 available by request