8015-5656 Screening compound: 5-(4-nitrophenyl)-3-[4-(1H-pyrrol-1-yl)phenyl]-1,2,4-oxadiazole

8015-5656 Screening compound: 5-(4-nitrophenyl)-3-[4-(1H-pyrrol-1-yl)phenyl]-1,2,4-oxadiazole
8015-5656 Screening compound: 5-(4-nitrophenyl)-3-[4-(1H-pyrrol-1-yl)phenyl]-1,2,4-oxadiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 8015-5656
5-(4-nitrophenyl)-3-[4-(1H-pyrrol-1-yl)phenyl]-1,2,4-oxadiazole

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

8015-5656

Molecular Formula

C18H12N4O3 (C18 H12 N4 O3)

Compound Name

5-(4-nitrophenyl)-3-[4-(1H-pyrrol-1-yl)phenyl]-1,2,4-oxadiazole

IUPAC name

5-(4-nitrophenyl)-3-[4-(1H-pyrrol-1-yl)phenyl]-124-oxadiazole

SMILES

[O-][N+](c(cc1)ccc1-c1nc(-c(cc2)ccc2-n2cccc2)no1)=O

InChI

InChI=1S/C18H12N4O3/c23-22(24)16-9-5-14(6-10-16)18-19-17(20-25-18)13-3-7-15(8-4-13)21-11-1-2-12-21/h1-12H

InChI Key

HTEKBKFIMNBKSX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05256858

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

332.32

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.951

Distribution Coefficient, logD

4.951

Water Solubility, LogSw

-5.10

Polar Surface Area

69.012

Acid Dissociation Constant (pKa)

14.00

Base Dissociation Constant (pKb)

-5.25

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

8015-5656 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Cancer

References: we are preparing a list of scientific research reports with 8015-5656 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8015-5656?
Check Price and Availability of 8015-5656, 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 8015-5656 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8015-5656
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8015-5656
  • 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 8015-5656 available by request