N-benzyl-N-[[3-(4-chlorophenoxy)phenyl]methyl]-2-phenylethanamine
Basic information
- CAS
415957-50-5- Standard SMILES
Clc1ccc(Oc2cccc(CN(CCc3ccccc3)Cc3ccccc3)c2)cc1- InChIKey
PMFBAQCHJRUNGX-UHFFFAOYSA-N- Molecular formula
- C28H26ClNO
- Average molar mass
- 428 g/mol
- Monoisotopic mass
- 427.1702921
Names & identifiers
- Preferred name
- N-benzyl-N-[[3-(4-chlorophenoxy)phenyl]methyl]-2-phenylethanamine
- IUPAC
- N-benzyl-N-[[3-(4-chlorophenoxy)phenyl]methyl]-2-phenylethanamine
Names & synonyms
415957-50-5N-[[3-(4-Chlorophenoxy)phenyl]methyl]-N-(phenylmethyl)benzeneethanamineDTXSID101152055N-benzyl-N-[[3-(4-chlorophenoxy)phenyl]methyl]-2-phenylethanamineN-benzyl-N-[3-(4-chlorophenoxy)benzyl]-2-phenylethanamineN-Benzyl-N-{[3-(4-chlorophenoxy)phenyl]methyl}-2-phenylethan-1-amine
Database identifiers
- CAS
415957-50-5- PubChem CID
- 2846147
- DTXSID
DTXSID101152055
Properties
Computed structural properties
- XLogP
- 7.4
- Topological polar surface area
- 12.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 9
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 479
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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