Basic information
- Standard SMILES
COC(=O)C1=C(Nc2ccc(OC)cc2)CC(C(=O)OC)=C(Nc2ccc(OC)cc2)C1- InChIKey
GOHOXUQLRKUBOF-UHFFFAOYSA-N- Molecular formula
- C24H26N2O6
- Average molar mass
- 438.5 g/mol
Names & identifiers
- Preferred name
- Dimethyl 2,5-bis{(4-methoxyphenyl)amino}cyclohexa-1,4-diene-1,4-dicarboxylate
- IUPAC
- dimethyl 2,5-bis(4-methoxyanilino)cyclohexa-1,4-diene-1,4-dicarboxylate
Names & synonyms
SCHEMBL1415808GOHOXUQLRKUBOF-UHFFFAOYSA-NDimethyl 2,5-bis{(4-methoxyphenyl)amino}cyclohexa-1,4-diene-1,4-dicarboxylate
Database identifiers
- PubChem CID
- 14745936
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 95.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 10
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 669
Related reactions
2 records
Compound notes
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