F489-0036 Screening compound: ethyl 1-(4-{3,4-dimethyl-7-oxo-6H,7H-[1,2]oxazolo[3,4-d]pyridazin-6-yl}butanoyl)piperidine-4-carboxylate

F489-0036 Screening compound: ethyl 1-(4-{3,4-dimethyl-7-oxo-6H,7H-[1,2]oxazolo[3,4-d]pyridazin-6-yl}butanoyl)piperidine-4-carboxylate
F489-0036 Screening compound: ethyl 1-(4-{3,4-dimethyl-7-oxo-6H,7H-[1,2]oxazolo[3,4-d]pyridazin-6-yl}butanoyl)piperidine-4-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound F489-0036
ethyl 1-(4-{3,4-dimethyl-7-oxo-6H,7H-[1,2]oxazolo[3,4-d]pyridazin-6-yl}butanoyl)piperidine-4-carboxylate

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

F489-0036

Molecular Formula

C19H26N4O5 (C19 H26 N4 O5)

Compound Name

ethyl 1-(4-{3,4-dimethyl-7-oxo-6H,7H-[1,2]oxazolo[3,4-d]pyridazin-6-yl}butanoyl)piperidine-4-carboxylate

IUPAC name

ethyl 1-(4-{34-dimethyl-7-oxo-6H7H-[12]oxazolo[34-d]pyridazin-6-yl}butanoyl)piperidine-4-carboxylate

SMILES

CCOC(C(CC1)CCN1C(CCCN1N=C(C)c2c(C)onc2C1=O)=O)=O

InChI

InChI=1S/C19H26N4O5/c1-4-27-19(26)14-7-10-22(11-8-14)15(24)6-5-9-23-18(25)17-16(12(2)20-23)13(3)28-21-17/h14H,4-11H2,1-3H3

InChI Key

AQIZVXGBISXCSO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27134247

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

390.44

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

0.563

Distribution Coefficient, logD

0.563

Water Solubility, LogSw

-0.51

Polar Surface Area

86.087

Acid Dissociation Constant (pKa)

23.24

Base Dissociation Constant (pKb)

3.68

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

63.20

F489-0036 in Drug Discovery

Included in Screening Libraries

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with F489-0036 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F489-0036?
Check Price and Availability of F489-0036, 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 F489-0036 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F489-0036
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F489-0036
  • 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 F489-0036 available by request