Basic information
- Standard SMILES
COc1ccc(-c2c(NC(C)c3ccccc3)c(=O)c2=O)cc1- InChIKey
NZYTWSXXHDZVBU-UHFFFAOYSA-N- Molecular formula
- C19H17NO3
- Average molar mass
- 307.3 g/mol
Names & identifiers
- Preferred name
- 3-(4-Methoxyphenyl)-4-(1-phenylethylamino)cyclobut-3-ene-1,2-dione
- IUPAC
- 3-(4-methoxyphenyl)-4-(1-phenylethylamino)cyclobut-3-ene-1,2-dione
Names & synonyms
SCHEMBL7689885
Database identifiers
- PubChem CID
- 9796589
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 55.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 497
Related reactions
1 records
Compound notes
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