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Basic information
- Standard SMILES
C=CCC1NCCN(C(Cc2ccc3ccccc3c2)C(=O)OC)C1=O- InChIKey
WJJRDQQSLKFKAM-UHFFFAOYSA-N- Molecular formula
- C21H24N2O3
- Average molar mass
- 352.4 g/mol
Names & identifiers
- Preferred name
- Methyl 3-naphthalen-2-yl-2-(2-oxo-3-prop-2-enylpiperazin-1-yl)propanoate
- IUPAC
- methyl 3-naphthalen-2-yl-2-(2-oxo-3-prop-2-enylpiperazin-1-yl)propanoate
Names & synonyms
SCHEMBL5844923
Database identifiers
- PubChem CID
- 69587789
Properties
Computed structural propertiesFilling in
- XLogP
- 3.4
- Topological polar surface area
- 58.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 521
Related reactions
2 records
Compound notes
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