F489-0313 Screening compound: N-isopropyl-4-[4-(4-methoxyphenyl)-3-methyl-7-oxoisoxazolo[3,4-d]pyridazin-6(7H)-yl]butanamide

F489-0313 Screening compound: N-isopropyl-4-[4-(4-methoxyphenyl)-3-methyl-7-oxoisoxazolo[3,4-d]pyridazin-6(7H)-yl]butanamide
F489-0313 Screening compound: N-isopropyl-4-[4-(4-methoxyphenyl)-3-methyl-7-oxoisoxazolo[3,4-d]pyridazin-6(7H)-yl]butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F489-0313
N-isopropyl-4-[4-(4-methoxyphenyl)-3-methyl-7-oxoisoxazolo[3,4-d]pyridazin-6(7H)-yl]butanamide

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

F489-0313

Molecular Formula

C20H24N4O4 (C20 H24 N4 O4)

Compound Name

N-isopropyl-4-[4-(4-methoxyphenyl)-3-methyl-7-oxoisoxazolo[3,4-d]pyridazin-6(7H)-yl]butanamide

IUPAC name

4-[4-(4-methoxyphenyl)-3-methyl-7-oxo-6H7H-[12]oxazolo[34-d]pyridazin-6-yl]-N-(propan-2-yl)butanamide

SMILES

CC(C)NC(CCCN(C(c1noc(C)c11)=O)N=C1c(cc1)ccc1OC)=O

InChI

InChI=1S/C20H24N4O4/c1-12(2)21-16(25)6-5-11-24-20(26)19-17(13(3)28-23-19)18(22-24)14-7-9-15(27-4)10-8-14/h7-10,12H,5-6,11H2,1-4H3,(H,21,25)

InChI Key

OHCTWHFWWBXXLU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27134301

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

384.44

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.351

Distribution Coefficient, logD

1.348

Water Solubility, LogSw

-2.03

Polar Surface Area

80.757

Acid Dissociation Constant (pKa)

15.34

Base Dissociation Constant (pKb)

5.27

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

F489-0313 in Drug Discovery

Included in Screening Libraries

Protein Kinases Inhibitors Library (36801 compounds)

Targeted Diversity Library (40567 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with F489-0313 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F489-0313?
Check Price and Availability of F489-0313, 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 F489-0313 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F489-0313
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F489-0313
  • 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 F489-0313 available by request