P894-0187 Screening compound: 4-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-[(pyridin-3-yl)methyl]phthalazin-1-amine

P894-0187 Screening compound: 4-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-[(pyridin-3-yl)methyl]phthalazin-1-amine
P894-0187 Screening compound: 4-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-[(pyridin-3-yl)methyl]phthalazin-1-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound P894-0187
4-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-[(pyridin-3-yl)methyl]phthalazin-1-amine

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

P894-0187

Molecular Formula

C22H15FN6O (C22 H15 FN6 O)

Compound Name

4-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-[(pyridin-3-yl)methyl]phthalazin-1-amine

IUPAC name

4-[3-(4-fluorophenyl)-124-oxadiazol-5-yl]-N-[(pyridin-3-yl)methyl]phthalazin-1-amine

SMILES

Fc(cc1)ccc1-c1noc(-c(c2ccccc22)nnc2NCc2cnccc2)n1

InChI

InChI=1S/C22H15FN6O/c23-16-9-7-15(8-10-16)20-26-22(30-29-20)19-17-5-1-2-6-18(17)21(28-27-19)25-13-14-4-3-11-24-12-14/h1-12H,13H2,(H,25,28)

InChI Key

FXNZUMHMUVQGKJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29026502

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

398.4

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.682

Distribution Coefficient, logD

3.653

Water Solubility, LogSw

-4.02

Polar Surface Area

74.278

Acid Dissociation Constant (pKa)

17.87

Base Dissociation Constant (pKb)

6.24

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.50

P894-0187 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Anticancer Library (62698 compounds)

C-Met Library (15277 compounds)

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Cancer
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Endocrine
  • Nervous system
Targets:
  • Kinases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with P894-0187 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P894-0187?
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What is the minimum amount of P894-0187 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P894-0187
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P894-0187
  • 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 P894-0187 available by request