Basic information
- Standard SMILES
Cc1ccc(NC(=O)c2ccc(Cl)nc2)cc1I- InChIKey
KMJCJZKVSPRHSD-UHFFFAOYSA-N- Molecular formula
- C13H10ClIN2O
- Average molar mass
- 372.59 g/mol
Names & identifiers
- Preferred name
- 6-chloro-N-(3-iodo-4-methyl-phenyl)-nicotinamide
- IUPAC
- 6-chloro-N-(3-iodo-4-methylphenyl)pyridine-3-carboxamide
Names & synonyms
SCHEMBL2306227KMJCJZKVSPRHSD-UHFFFAOYSA-NAKOS0089213436-chloro-N-(3-iodo-4-methyl-phenyl)-nicotinamide
Database identifiers
- PubChem CID
- 7925562
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 42 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 303
Related reactions
17 records
Compound notes
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