Basic information
- Standard SMILES
c1ccc(CN2CCCCC(NC(c3ccccc3)(c3ccccc3)c3ccccc3)C2)cc1- InChIKey
CCIKHLHJKLETJK-UHFFFAOYSA-N- Molecular formula
- C32H34N2
- Average molar mass
- 446.6 g/mol
- Monoisotopic mass
- 446.27219909
Names & identifiers
- Preferred name
- 1-benzyl-N-trityl-3-azepanamine
- IUPAC
- 1-benzyl-N-tritylazepan-3-amine
Names & synonyms
SCHEMBL54018291-benzyl-N-trityl-3-azepanamineCCIKHLHJKLETJK-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 69428688
Properties
Computed structural properties
- XLogP
- 6.9
- Topological polar surface area
- 15.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 7
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 518
Related reactions
4 records
Compound notes
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