Basic information
- Standard SMILES
COc1ccc(CNC(=O)c2cc(I)ccc2Cl)c(OC)c1- InChIKey
YSSLKYQCTMJSIW-UHFFFAOYSA-N- Molecular formula
- C16H15ClINO3
- Average molar mass
- 431.65 g/mol
Names & identifiers
- Preferred name
- N-{[2,4-bis(methyloxy)phenyl]methyl)-2-chloro-5-iodobenzamide
- IUPAC
- 2-chloro-N-[(2,4-dimethoxyphenyl)methyl]-5-iodobenzamide
Names & synonyms
N-{[2,4-bis(methyloxy)phenyl]methyl)-2-chloro-5-iodobenzamideN-{[2,4-bis(methyloxy)phenyl]methyl}-2-chloro-5-iodobenzamideSCHEMBL3530201YSSLKYQCTMJSIW-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 58728071
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 47.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 371
Related reactions
2 records
Compound notes
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