Basic information
- Standard SMILES
CC(C)C(C(=O)OCc1cccc(Cc2ccccc2)n1)c1ccc2ccccc2c1- InChIKey
VGPVHDSSUFVSPN-UHFFFAOYSA-N- Molecular formula
- C28H27NO2
- Average molar mass
- 409.5 g/mol
Names & identifiers
- Preferred name
- (6-Benzyl-2-pyridyl)methyl 2-(2-naphthyl)-3-methylbutanoate
- IUPAC
- (6-benzyl-2-pyridinyl)methyl 3-methyl-2-naphthalen-2-ylbutanoate
Names & synonyms
SCHEMBL11461984VGPVHDSSUFVSPN-UHFFFAOYSA-N(6-benzyl-2-pyridyl)methyl 2-(2-naphthyl)-3-methylbutanoate
Database identifiers
- PubChem CID
- 23341806
Properties
Computed structural properties
- XLogP
- 6.7
- Topological polar surface area
- 39.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 8
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 555
Related reactions
2 records
Compound notes
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