F279-0405 Screening compound: 6-[(3-chlorophenyl)methyl]-3,4-dimethyl-6H,7H-[1,2]oxazolo[3,4-d]pyridazin-7-one

F279-0405 Screening compound: 6-[(3-chlorophenyl)methyl]-3,4-dimethyl-6H,7H-[1,2]oxazolo[3,4-d]pyridazin-7-one
F279-0405 Screening compound: 6-[(3-chlorophenyl)methyl]-3,4-dimethyl-6H,7H-[1,2]oxazolo[3,4-d]pyridazin-7-one alternative view

Chemical Structure Depiction of ChemDiv screening compound F279-0405
6-[(3-chlorophenyl)methyl]-3,4-dimethyl-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

F279-0405

Molecular Formula

C14H12ClN3O2 (C14 H12 ClN3 O2)

Compound Name

6-[(3-chlorophenyl)methyl]-3,4-dimethyl-6H,7H-[1,2]oxazolo[3,4-d]pyridazin-7-one

IUPAC name

6-[(3-chlorophenyl)methyl]-34-dimethyl-6H7H-[12]oxazolo[34-d]pyridazin-7-one

SMILES

Cc(onc12)c2C(C)=NN(Cc2cccc(Cl)c2)C1=O

InChI

InChI=1S/C14H12ClN3O2/c1-8-12-9(2)20-17-13(12)14(19)18(16-8)7-10-4-3-5-11(15)6-10/h3-6H,7H2,1-2H3

InChI Key

KYHDZVCKQRERBZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27111420

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

289.72

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.569

Distribution Coefficient, logD

2.569

Water Solubility, LogSw

-3.44

Polar Surface Area

48.962

Acid Dissociation Constant (pKa)

22.37

Base Dissociation Constant (pKb)

3.17

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.40

F279-0405 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Fragments Library (11262 compounds)

Targeted Diversity Library (40567 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with F279-0405 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F279-0405?
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What is the minimum amount of F279-0405 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F279-0405
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F279-0405
  • 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 F279-0405 available by request