Home
MCP
Workbench
Skills
More
English
English
Home
Workbench
Notifications
Me
Home
/
Compound
N-(2-bromo-4,5-dimethoxyphenyl)-2-(4-fluorophenyl)-4-oxo-2,3-dihydropyridine-1-carboxamide
HCID
75214946
Save
New note
New reaction
Request quotes
Share
Print preview
Basic information
Names & identifiers
Properties
Related reactions
Compound notes
Substructure search
Find similar structures
Basic information
Standard SMILES
COc1cc(Br)c(NC(=O)N2C=CC(=O)CC2c2ccc(F)cc2)cc1OC
InChIKey
GPPBDRUBCOWLIV-UHFFFAOYSA-N
Molecular formula
C20H18BrFN2O4
Average molar mass
449.3 g/mol
Names & identifiers
Preferred name
N-(2-bromo-4,5-dimethoxyphenyl)-2-(4-fluorophenyl)-4-oxo-2,3-dihydropyridine-1-carboxamide
IUPAC
N-(2-bromo-4,5-dimethoxyphenyl)-2-(4-fluorophenyl)-4-oxo-2,3-dihydropyridine-1-carboxamide
Database identifiers
PubChem CID
75214946
Properties
Computed structural properties
XLogP
3
Topological polar surface area
67.9 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
4
Heavy atoms
28
Formal charge
0
Complexity
597
Show all 8
Show all 8 / 8
Related reactions
1 records
New reaction record
All
As reactant
As product
As reagent
As catalyst
As solvent
HRID
1240250
As product
Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Compound notes
Loading…
More actions
Save
New note
New reaction
Request quotes