F279-0122 Screening compound: ethyl 4-{2-[4-(3-methoxyphenyl)-3-methyl-7-oxo-6H,7H-[1,2]oxazolo[3,4-d]pyridazin-6-yl]acetamido}benzoate
Chemical Structure Depiction of ChemDiv screening compound F279-0122
ethyl 4-{2-[4-(3-methoxyphenyl)-3-methyl-7-oxo-6H,7H-[1,2]oxazolo[3,4-d]pyridazin-6-yl]acetamido}benzoate
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
F279-0122
Molecular Formula
C24H22N4O6 (C24 H22 N4 O6)
Compound Name
ethyl 4-{2-[4-(3-methoxyphenyl)-3-methyl-7-oxo-6H,7H-[1,2]oxazolo[3,4-d]pyridazin-6-yl]acetamido}benzoate
IUPAC name
ethyl 4-{2-[4-(3-methoxyphenyl)-3-methyl-7-oxo-6H7H-[12]oxazolo[34-d]pyridazin-6-yl]acetamido}benzoate
SMILES
CCOC(c(cc1)ccc1NC(CN(C(c1noc(C)c11)=O)N=C1c1cc(OC)ccc1)=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
462.46
Hydrogen Bond Acceptors Count
11.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
9.00
Number of Nitrogen and Oxygen Atoms
10
Partition Coefficient, logP
3.518
Distribution Coefficient, logD
3.518
Water Solubility, LogSw
-3.85
Polar Surface Area
100.965
Acid Dissociation Constant (pKa)
11.51
Base Dissociation Constant (pKb)
1.33
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
20.80
F279-0122 in Drug Discovery
Included in Screening Libraries
Anticancer Library (62698 compounds)
Adenosine Receptors Targeted Library (19896 compounds)
Included in 1.7M Stock Database
- Cancer
- Cancer
- Digestive system
- Respiratory tract
- Nervous system
- Eye
- Cardiovascular
- GPCR
- Receptor's ligands
References: we are preparing a list of scientific research reports with F279-0122 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)