Basic information
- CAS
320419-81-6- Standard SMILES
COc1cc(NC(=O)c2cccn(Cc3ccc(Cl)cc3Cl)c2=O)cc(OC)c1OC- InChIKey
XJUASDAMFZGFOS-UHFFFAOYSA-N- Molecular formula
- C22H20Cl2N2O5
- Average molar mass
- 463.3 g/mol
Names & identifiers
- Preferred name
- 1-[(2,4-dichlorophenyl)methyl]-2-oxo-N-(3,4,5-trimethoxyphenyl)pyridine-3-carboxamide
- IUPAC
- 1-[(2,4-dichlorophenyl)methyl]-2-oxo-N-(3,4,5-trimethoxyphenyl)pyridine-3-carboxamide
- English name
- 1-(2,4-Dichlorobenzyl)-2-oxo-N-(3,4,5-trimethoxyphenyl)-1,2-dihydro-3-pyridinecarboxamide
- Molecular formula
- C22H20Cl2N2O5
- Molecular weight
- 463.31
Names & synonyms
320419-81-61-(2,4-dichlorobenzyl)-2-oxo-N-(3,4,5-trimethoxyphenyl)-1,2-dihydro-3-pyridinecarboxamide1-[(2,4-dichlorophenyl)methyl]-2-oxo-N-(3,4,5-trimethoxyphenyl)pyridine-3-carboxamide1-[(2,4-dichlorophenyl)methyl]-2-oxo-N-(3,4,5-trimethoxyphenyl)-1,2-dihydropyridine-3-carboxamideOprea1_564737AKOS0050821681F-351S1-(2,4-Dichlorobenzyl)-2-oxo-N-(3,4,5-trimethoxyphenyl)-1,2-dihydropyridine-3-carboxamide3-Pyridinecarboxamide, 1-[(2,4-dichlorophenyl)methyl]-1,2-dihydro-2-oxo-N-(3,4,5-trimethoxyphenyl)-
Database identifiers
- CAS
320419-81-6
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 77.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 702
Physicochemical properties
- Boiling point
- 672 · 672.0±55.0 °C(Predicted)
- Density
- 1.398 · 1.398±0.06 g/cm3(Predicted)
- pka
- 10.83 · 10.83±0.70(Predicted)
Chemistry & industry
Suppliers3 total
Ryan Scientific, Inc.[email protected]
Key Organics Ltd.[email protected]
BIONET-INTER[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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