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Basic information
- Standard SMILES
Cn1cc(C(=O)NCc2ccc(Cl)cc2)c(=O)c2cc(I)ccc21- InChIKey
WWBXCGHLAABQKV-UHFFFAOYSA-N- Molecular formula
- C18H14ClIN2O2
- Average molar mass
- 452.7 g/mol
Names & identifiers
- Preferred name
- N-(4-Chlorobenzyl)-6-iodo-1-methyl-4-oxo-1,4-dihydro-3-quinolinecarboxamide
- IUPAC
- N-[(4-chlorophenyl)methyl]-6-iodo-1-methyl-4-oxoquinoline-3-carboxamide
Names & synonyms
SCHEMBL7938457WWBXCGHLAABQKV-UHFFFAOYSA-NN-(4-Chlorobenzyl)-6-iodo-1-methyl-4-oxo-1,4-dihydro-3-quinolinecarboxamide
Database identifiers
- PubChem CID
- 21192528
Properties
Computed structural propertiesFilling in
- XLogP
- 4.5
- Topological polar surface area
- 49.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 531
Related reactions
3 records
Compound notes
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