P893-0051 Screening compound: 1-[4-(2-fluorophenyl)piperazin-1-yl]-4-(5-methyl-1,3,4-oxadiazol-2-yl)phthalazine

P893-0051 Screening compound: 1-[4-(2-fluorophenyl)piperazin-1-yl]-4-(5-methyl-1,3,4-oxadiazol-2-yl)phthalazine
P893-0051 Screening compound: 1-[4-(2-fluorophenyl)piperazin-1-yl]-4-(5-methyl-1,3,4-oxadiazol-2-yl)phthalazine alternative view

Chemical Structure Depiction of ChemDiv screening compound P893-0051
1-[4-(2-fluorophenyl)piperazin-1-yl]-4-(5-methyl-1,3,4-oxadiazol-2-yl)phthalazine

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

P893-0051

Molecular Formula

C21H19FN6O (C21 H19 FN6 O)

Compound Name

1-[4-(2-fluorophenyl)piperazin-1-yl]-4-(5-methyl-1,3,4-oxadiazol-2-yl)phthalazine

IUPAC name

1-[4-(2-fluorophenyl)piperazin-1-yl]-4-(5-methyl-134-oxadiazol-2-yl)phthalazine

SMILES

Cc1nnc(-c(c2ccccc22)nnc2N(CC2)CCN2c(cccc2)c2F)o1

InChI

InChI=1S/C21H19FN6O/c1-14-23-26-21(29-14)19-15-6-2-3-7-16(15)20(25-24-19)28-12-10-27(11-13-28)18-9-5-4-8-17(18)22/h2-9H,10-13H2,1H3

InChI Key

OVDCOPLFSYBVHT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29026511

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

390.42

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.327

Distribution Coefficient, logD

3.323

Water Solubility, LogSw

-3.46

Polar Surface Area

58.569

Acid Dissociation Constant (pKa)

23.22

Base Dissociation Constant (pKb)

5.27

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.80

P893-0051 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system

References: we are preparing a list of scientific research reports with P893-0051 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P893-0051?
Check Price and Availability of P893-0051, 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 P893-0051 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P893-0051
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P893-0051
  • 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 P893-0051 available by request