P894-0022 Screening compound: 1-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-4-(4-methylpiperidin-1-yl)phthalazine

P894-0022 Screening compound: 1-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-4-(4-methylpiperidin-1-yl)phthalazine
P894-0022 Screening compound: 1-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-4-(4-methylpiperidin-1-yl)phthalazine alternative view

Chemical Structure Depiction of ChemDiv screening compound P894-0022
1-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-4-(4-methylpiperidin-1-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

P894-0022

Molecular Formula

C19H21N5O (C19 H21 N5 O)

Compound Name

1-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-4-(4-methylpiperidin-1-yl)phthalazine

IUPAC name

1-(3-cyclopropyl-124-oxadiazol-5-yl)-4-(4-methylpiperidin-1-yl)phthalazine

SMILES

CC(CC1)CCN1c1nnc(-c2nc(C3CC3)no2)c2ccccc12

InChI

InChI=1S/C19H21N5O/c1-12-8-10-24(11-9-12)18-15-5-3-2-4-14(15)16(21-22-18)19-20-17(23-25-19)13-6-7-13/h2-5,12-13H,6-11H2,1H3

InChI Key

KVHPAXQQCXJUQE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29027143

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

335.41

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.306

Distribution Coefficient, logD

4.301

Water Solubility, LogSw

-4.23

Polar Surface Area

57.795

Acid Dissociation Constant (pKa)

22.73

Base Dissociation Constant (pKb)

5.46

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

47.40

P894-0022 in Drug Discovery

Included in Screening Libraries

GPCR Targeted Library (31838 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with P894-0022 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P894-0022?
Check Price and Availability of P894-0022, 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 P894-0022 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P894-0022
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P894-0022
  • 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 P894-0022 available by request