2-(2-chlorophenyl)-N-(4-methyl-3-nitrophenyl)quinoline-4-carboxamide
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Basic information
- CAS
420090-56-8- Standard SMILES
Cc1ccc(NC(=O)c2cc(-c3ccccc3Cl)nc3ccccc23)cc1[N+](=O)[O-]- InChIKey
XCQGPFHCMYBNFR-UHFFFAOYSA-N- Molecular formula
- C23H16ClN3O3
- Average molar mass
- 417.8 g/mol
- Monoisotopic mass
- 417.0880191
Names & identifiers
- Preferred name
- 2-(2-chlorophenyl)-N-(4-methyl-3-nitrophenyl)quinoline-4-carboxamide
- IUPAC
- 2-(2-chlorophenyl)-N-(4-methyl-3-nitrophenyl)quinoline-4-carboxamide
- English name
- 2-(2-chlorophenyl)-N-{3-nitro-4-methylphenyl}-4-quinolinecarboxamide
- Molecular formula
- C23H16ClN3O3
- Molecular weight
- 417.84444
Names & synonyms
2-(2-chlorophenyl)-N-(4-methyl-3-nitrophenyl)quinoline-4-carboxamideOprea1_352823STK427994AKOS003254854ST50914715AK-968/11989446[2-(2-chlorophenyl)(4-quinolyl)]-N-(4-methyl-3-nitrophenyl)carboxamide2-(2-chlorophenyl)-N-{3-nitro-4-methylphenyl}-4-quinolinecarboxamide420090-56-8
Database identifiers
- CAS
420090-56-8- PubChem CID
- 1741232
Properties
Computed structural propertiesFilling in
- XLogP
- 5.5
- Topological polar surface area
- 87.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 627
Related reactions
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Compound notes
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