F279-0054 Screening compound: 6-[(2-chloro-6-fluorophenyl)methyl]-4-(3-methoxyphenyl)-3-methyl-6H,7H-[1,2]oxazolo[3,4-d]pyridazin-7-one

F279-0054 Screening compound: 6-[(2-chloro-6-fluorophenyl)methyl]-4-(3-methoxyphenyl)-3-methyl-6H,7H-[1,2]oxazolo[3,4-d]pyridazin-7-one
F279-0054 Screening compound: 6-[(2-chloro-6-fluorophenyl)methyl]-4-(3-methoxyphenyl)-3-methyl-6H,7H-[1,2]oxazolo[3,4-d]pyridazin-7-one alternative view

Chemical Structure Depiction of ChemDiv screening compound F279-0054
6-[(2-chloro-6-fluorophenyl)methyl]-4-(3-methoxyphenyl)-3-methyl-6H,7H-[1,2]oxazolo[3,4-d]pyridazin-7-one

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

F279-0054

Molecular Formula

C20H15ClFN3O3 (C20 H15 ClFN3 O3)

Compound Name

6-[(2-chloro-6-fluorophenyl)methyl]-4-(3-methoxyphenyl)-3-methyl-6H,7H-[1,2]oxazolo[3,4-d]pyridazin-7-one

IUPAC name

6-[(2-chloro-6-fluorophenyl)methyl]-4-(3-methoxyphenyl)-3-methyl-6H7H-[12]oxazolo[34-d]pyridazin-7-one

SMILES

Cc(onc12)c2C(c2cc(OC)ccc2)=NN(Cc(c(F)ccc2)c2Cl)C1=O

InChI

InChI=1S/C20H15ClFN3O3/c1-11-17-18(12-5-3-6-13(9-12)27-2)23-25(20(26)19(17)24-28-11)10-14-15(21)7-4-8-16(14)22/h3-9H,10H2,1-2H3

InChI Key

PJHHYNDVTUCHNU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14946998

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

399.81

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.942

Distribution Coefficient, logD

3.937

Water Solubility, LogSw

-4.60

Polar Surface Area

57.061

Acid Dissociation Constant (pKa)

22.88

Base Dissociation Constant (pKb)

5.50

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.00

F279-0054 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
  • Nervous system
  • Cardiovascular
Agro:
  • Agro
Targets:
  • GPCR
  • Ion Channels
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with F279-0054 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F279-0054?
Check Price and Availability of F279-0054, 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 F279-0054 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F279-0054
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F279-0054
  • 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 F279-0054 available by request