Basic information
- Standard SMILES
COC(=O)c1ccc(CNC(=O)c2cc(OCc3cccc(Cl)c3)ccc2Cl)cc1- InChIKey
VJBQUHGFRFFSAG-UHFFFAOYSA-N- Molecular formula
- C23H19Cl2NO4
- Average molar mass
- 444.3 g/mol
Names & identifiers
- Preferred name
- Methyl 4-({[(2-chloro-5-{[(3-chlorophenyl)methyl]oxy}phenyl)carbonyl]amino}methyl)benzoate
- IUPAC
- methyl 4-[[[2-chloro-5-[(3-chlorophenyl)methoxy]benzoyl]amino]methyl]benzoate
Names & synonyms
SCHEMBL2908929VJBQUHGFRFFSAG-UHFFFAOYSA-Nmethyl 4-({[(2-chloro-5-{[(3-chlorophenyl)methyl]oxy}phenyl)carbonyl]amino}methyl)benzoate
Database identifiers
- PubChem CID
- 59608424
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 64.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 567
Related reactions
2 records
Compound notes
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