F489-0104 Screening compound: 6-(4-{1,4-dioxa-8-azaspiro[4.5]decan-8-yl}-4-oxobutyl)-3,4-dimethyl-6H,7H-[1,2]oxazolo[3,4-d]pyridazin-7-one

F489-0104 Screening compound: 6-(4-{1,4-dioxa-8-azaspiro[4.5]decan-8-yl}-4-oxobutyl)-3,4-dimethyl-6H,7H-[1,2]oxazolo[3,4-d]pyridazin-7-one
F489-0104 Screening compound: 6-(4-{1,4-dioxa-8-azaspiro[4.5]decan-8-yl}-4-oxobutyl)-3,4-dimethyl-6H,7H-[1,2]oxazolo[3,4-d]pyridazin-7-one alternative view

Chemical Structure Depiction of ChemDiv screening compound F489-0104
6-(4-{1,4-dioxa-8-azaspiro[4.5]decan-8-yl}-4-oxobutyl)-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

F489-0104

Molecular Formula

C18H24N4O5 (C18 H24 N4 O5)

Compound Name

6-(4-{1,4-dioxa-8-azaspiro[4.5]decan-8-yl}-4-oxobutyl)-3,4-dimethyl-6H,7H-[1,2]oxazolo[3,4-d]pyridazin-7-one

IUPAC name

6-(4-{14-dioxa-8-azaspiro[4.5]decan-8-yl}-4-oxobutyl)-34-dimethyl-6H7H-[12]oxazolo[34-d]pyridazin-7-one

SMILES

Cc(onc12)c2C(C)=NN(CCCC(N(CC2)CCC22OCCO2)=O)C1=O

InChI

InChI=1S/C18H24N4O5/c1-12-15-13(2)27-20-16(15)17(24)22(19-12)7-3-4-14(23)21-8-5-18(6-9-21)25-10-11-26-18/h3-11H2,1-2H3

InChI Key

CSZMBWIREMEKPR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27134275

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

376.41

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

-0.287

Distribution Coefficient, logD

-0.287

Water Solubility, LogSw

0.35

Polar Surface Area

79.770

Acid Dissociation Constant (pKa)

23.44

Base Dissociation Constant (pKb)

3.68

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

66.70

F489-0104 in Drug Discovery

Included in Screening Libraries

GPCR Targeted Library (31838 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with F489-0104 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F489-0104?
Check Price and Availability of F489-0104, 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 F489-0104 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F489-0104
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F489-0104
  • 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 F489-0104 available by request