P894-0194 Screening compound: N-[2-(DIMETHYLAMINO)ETHYL]-N-{4-[3-(4-FLUOROPHENYL)-1,2,4-OXADIAZOL-5-YL]-1-PHTHALAZINYL}AMINE

P894-0194 Screening compound: N-[2-(DIMETHYLAMINO)ETHYL]-N-{4-[3-(4-FLUOROPHENYL)-1,2,4-OXADIAZOL-5-YL]-1-PHTHALAZINYL}AMINE
P894-0194 Screening compound: N-[2-(DIMETHYLAMINO)ETHYL]-N-{4-[3-(4-FLUOROPHENYL)-1,2,4-OXADIAZOL-5-YL]-1-PHTHALAZINYL}AMINE alternative view

Chemical Structure Depiction of ChemDiv screening compound P894-0194
N-[2-(DIMETHYLAMINO)ETHYL]-N-{4-[3-(4-FLUOROPHENYL)-1,2,4-OXADIAZOL-5-YL]-1-PHTHALAZINYL}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

P894-0194

Molecular Formula

C20H19FN6O (C20 H19 FN6 O)

Compound Name

N-[2-(DIMETHYLAMINO)ETHYL]-N-{4-[3-(4-FLUOROPHENYL)-1,2,4-OXADIAZOL-5-YL]-1-PHTHALAZINYL}AMINE

IUPAC name

N-[2-(dimethylamino)ethyl]-4-[3-(4-fluorophenyl)-124-oxadiazol-5-yl]phthalazin-1-amine

SMILES

CN(C)CCNc1nnc(-c2nc(-c(cc3)ccc3F)no2)c2ccccc12

InChI

InChI=1S/C20H19FN6O/c1-27(2)12-11-22-19-16-6-4-3-5-15(16)17(24-25-19)20-23-18(26-28-20)13-7-9-14(21)10-8-13/h3-10H,11-12H2,1-2H3,(H,22,25)

InChI Key

OYKQHHCHDCVXSF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29028257

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

378.41

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.669

Distribution Coefficient, logD

1.708

Water Solubility, LogSw

-3.93

Polar Surface Area

68.739

Acid Dissociation Constant (pKa)

18.79

Base Dissociation Constant (pKb)

9.36

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

P894-0194 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Anticancer Library (62698 compounds)

Antiviral Library (67538 compounds)

C-Met Library (15277 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with P894-0194 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P894-0194?
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What is the minimum amount of P894-0194 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P894-0194
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P894-0194
  • 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 P894-0194 available by request