Basic information
- Standard SMILES
CN1CCN(C(=O)OCc2ccccc2)C(C(O)C(Cc2ccccc2)N(Cc2ccccc2)Cc2ccccc2)C1=O- InChIKey
SXVFYUVWFPLRRX-UHFFFAOYSA-N- Molecular formula
- C36H39N3O4
- Average molar mass
- 577.7 g/mol
Names & identifiers
- Preferred name
- Benzyl 2-[2-(dibenzylamino)-1-hydroxy-3-phenylpropyl]-4-methyl-3-oxopiperazine-1-carboxylate
- IUPAC
- benzyl 2-[2-(dibenzylamino)-1-hydroxy-3-phenylpropyl]-4-methyl-3-oxopiperazine-1-carboxylate
Database identifiers
- PubChem CID
- 77589983
Properties
Computed structural properties
- XLogP
- 5.9
- Topological polar surface area
- 73.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 12
- Heavy atoms
- 43
- Formal charge
- 0
- Complexity
- 825
Related reactions
1 records
Compound notes
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