P507-0501 Screening compound: 4-{3-[1-(3-fluorophenyl)-1H-1,2,3-triazol-4-yl]-1,2,4-oxadiazol-5-yl}benzonitrile

P507-0501 Screening compound: 4-{3-[1-(3-fluorophenyl)-1H-1,2,3-triazol-4-yl]-1,2,4-oxadiazol-5-yl}benzonitrile
P507-0501 Screening compound: 4-{3-[1-(3-fluorophenyl)-1H-1,2,3-triazol-4-yl]-1,2,4-oxadiazol-5-yl}benzonitrile alternative view

Chemical Structure Depiction of ChemDiv screening compound P507-0501
4-{3-[1-(3-fluorophenyl)-1H-1,2,3-triazol-4-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

P507-0501

Molecular Formula

C17H9FN6O (C17 H9 FN6 O)

Compound Name

4-{3-[1-(3-fluorophenyl)-1H-1,2,3-triazol-4-yl]-1,2,4-oxadiazol-5-yl}benzonitrile

IUPAC name

4-{3-[1-(3-fluorophenyl)-1H-123-triazol-4-yl]-124-oxadiazol-5-yl}benzonitrile

SMILES

N#Cc(cc1)ccc1-c1nc(-c2cn(-c3cccc(F)c3)nn2)no1

InChI

InChI=1S/C17H9FN6O/c18-13-2-1-3-14(8-13)24-10-15(21-23-24)16-20-17(25-22-16)12-6-4-11(9-19)5-7-12/h1-8,10H

InChI Key

LPLZJSLVMSQULD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27577354

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

332.3

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.238

Distribution Coefficient, logD

3.238

Water Solubility, LogSw

-3.30

Polar Surface Area

75.066

Acid Dissociation Constant (pKa)

14.00

Base Dissociation Constant (pKb)

-2.49

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

P507-0501 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with P507-0501 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P507-0501?
Check Price and Availability of P507-0501, 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 P507-0501 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P507-0501
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P507-0501
  • 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 P507-0501 available by request