F489-0330 Screening compound: 4-(4-METHOXYPHENYL)-3-METHYL-6-(4-MORPHOLINO-4-OXOBUTYL)ISOXAZOLO[3,4-D]PYRIDAZIN-7(6H)-ONE
Chemical Structure Depiction of ChemDiv screening compound F489-0330
4-(4-METHOXYPHENYL)-3-METHYL-6-(4-MORPHOLINO-4-OXOBUTYL)ISOXAZOLO[3,4-D]PYRIDAZIN-7(6H)-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
F489-0330
Molecular Formula
C21H24N4O5 (C21 H24 N4 O5)
Compound Name
4-(4-METHOXYPHENYL)-3-METHYL-6-(4-MORPHOLINO-4-OXOBUTYL)ISOXAZOLO[3,4-D]PYRIDAZIN-7(6H)-ONE
IUPAC name
n/a
SMILES
Cc(onc12)c2C(c(cc2)ccc2OC)=NN(CCCC(N2CCOCC2)=O)C1=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
412.45
Hydrogen Bond Acceptors Count
9.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
7.00
Number of Nitrogen and Oxygen Atoms
9
Partition Coefficient, logP
0.690
Distribution Coefficient, logD
0.686
Water Solubility, LogSw
-1.45
Polar Surface Area
81.341
Acid Dissociation Constant (pKa)
23.56
Base Dissociation Constant (pKb)
5.27
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
42.90
F489-0330 in Drug Discovery
Included in Screening Libraries
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
Protein Kinases Inhibitors Library (36801 compounds)
Adenosine Receptors Targeted Library (19896 compounds)
Included in 1.7M Stock Database
- Cancer
- Digestive system
- Respiratory tract
- Otorhinolaryngologic
- Nervous system
- Hemic and lymphatic
- Cardiovascular
- Cancer
- Digestive system
- Respiratory tract
- Nervous system
- Eye
- Cardiovascular
- Kinases
- GPCR
- Receptor's ligands
References: we are preparing a list of scientific research reports with F489-0330 chemical compound. It will be published here after verification.
Frequently Asked Questions
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Available from 1 mg in Glass Vials or 96-tube racks.
ChemDiv sends parcels with Express services (UPS, WC).
- 1–2 days for small orders
- 2–4 weeks for large selections
- 0.5–50 mg of dry powder sample in single glass vials, custom vials
- DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)