P507-0401 Screening compound: 3-{3-[1-(3-fluorophenyl)-1H-1,2,3-triazol-4-yl]-1,2,4-oxadiazol-5-yl}pyridine

P507-0401 Screening compound: 3-{3-[1-(3-fluorophenyl)-1H-1,2,3-triazol-4-yl]-1,2,4-oxadiazol-5-yl}pyridine
P507-0401 Screening compound: 3-{3-[1-(3-fluorophenyl)-1H-1,2,3-triazol-4-yl]-1,2,4-oxadiazol-5-yl}pyridine alternative view

Chemical Structure Depiction of ChemDiv screening compound P507-0401
3-{3-[1-(3-fluorophenyl)-1H-1,2,3-triazol-4-yl]-1,2,4-oxadiazol-5-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

P507-0401

Molecular Formula

C15H9FN6O (C15 H9 FN6 O)

Compound Name

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

IUPAC name

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

SMILES

Fc1cc(-n2nnc(-c3noc(-c4cnccc4)n3)c2)ccc1

InChI

InChI=1S/C15H9FN6O/c16-11-4-1-5-12(7-11)22-9-13(19-21-22)14-18-15(23-20-14)10-3-2-6-17-8-10/h1-9H

InChI Key

XCKNQHDSGBFNOD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27577336

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

308.27

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.198

Distribution Coefficient, logD

2.194

Water Solubility, LogSw

-1.99

Polar Surface Area

67.527

Acid Dissociation Constant (pKa)

14.00

Base Dissociation Constant (pKb)

5.39

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

P507-0401 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with P507-0401 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P507-0401?
Check Price and Availability of P507-0401, 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 P507-0401 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P507-0401
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P507-0401
  • 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 P507-0401 available by request