P039-1533 Screening compound: N-(3-fluorophenyl)-2-{3-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-6-oxo-1,4,5,6-tetrahydropyridazin-1-yl}acetamide

P039-1533 Screening compound: N-(3-fluorophenyl)-2-{3-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-6-oxo-1,4,5,6-tetrahydropyridazin-1-yl}acetamide
P039-1533 Screening compound: N-(3-fluorophenyl)-2-{3-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-6-oxo-1,4,5,6-tetrahydropyridazin-1-yl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P039-1533
N-(3-fluorophenyl)-2-{3-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-6-oxo-1,4,5,6-tetrahydropyridazin-1-yl}acetamide

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

P039-1533

Molecular Formula

C21H18FN5O3 (C21 H18 FN5 O3)

Compound Name

N-(3-fluorophenyl)-2-{3-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-6-oxo-1,4,5,6-tetrahydropyridazin-1-yl}acetamide

IUPAC name

N-(3-fluorophenyl)-2-{3-[3-(4-methylphenyl)-124-oxadiazol-5-yl]-6-oxo-1456-tetrahydropyridazin-1-yl}acetamide

SMILES

Cc(cc1)ccc1-c1noc(C(CC2)=NN(CC(Nc3cccc(F)c3)=O)C2=O)n1

InChI

InChI=1S/C21H18FN5O3/c1-13-5-7-14(8-6-13)20-24-21(30-26-20)17-9-10-19(29)27(25-17)12-18(28)23-16-4-2-3-15(22)11-16/h2-8,11H,9-10,12H2,1H3,(H,23,28)

InChI Key

AWRHLOKRNXAPFT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27559815

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

407.4

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.650

Distribution Coefficient, logD

3.650

Water Solubility, LogSw

-3.86

Polar Surface Area

83.374

Acid Dissociation Constant (pKa)

11.03

Base Dissociation Constant (pKb)

0.91

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.00

P039-1533 in Drug Discovery

Included in Screening Libraries

C-Met Library (15277 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • 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 P039-1533 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P039-1533?
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What is the minimum amount of P039-1533 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P039-1533
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P039-1533
  • 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 P039-1533 available by request