3-(4-Methoxy-2-phenoxy-phenylamino)-phthalic acid
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Basic information
- Standard SMILES
COc1ccc(Nc2cccc(C(=O)O)c2C(=O)O)c(Oc2ccccc2)c1- InChIKey
COQYBLZZUQVBPA-UHFFFAOYSA-N- Molecular formula
- C21H17NO6
- Average molar mass
- 379.4 g/mol
Names & identifiers
- Preferred name
- 3-(4-Methoxy-2-phenoxy-phenylamino)-phthalic acid
- IUPAC
- 3-(4-methoxy-2-phenoxyanilino)phthalic acid
Names & synonyms
SCHEMBL1964690COQYBLZZUQVBPA-UHFFFAOYSA-N3-(4-Methoxy-2-phenoxy-phenylamino)-phthalic acid
Database identifiers
- PubChem CID
- 58307166
Properties
Computed structural propertiesFilling in
- XLogP
- 5.6
- Topological polar surface area
- 105 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 7
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 535
Related reactions
2 records
Compound notes
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