Piperazine, 1-benzyl-4-(6-methyl-1,1'-biphenyl-3-yl)-, oxalate
Basic information
- CAS
13480-29-0- Standard SMILES
Cc1ccc(N2CCN(Cc3ccccc3)CC2)cc1-c1ccccc1.O=C(O)C(=O)O- InChIKey
AWEFZLXJKWBCDG-UHFFFAOYSA-N- Molecular formula
- C26H28N2O4
- Average molar mass
- 432.5 g/mol
- Monoisotopic mass
- 432.20490738
Names & identifiers
- Preferred name
- Piperazine, 1-benzyl-4-(6-methyl-1,1'-biphenyl-3-yl)-, oxalate
- IUPAC
- 1-benzyl-4-(4-methyl-3-phenylphenyl)piperazine;oxalic acid
Names & synonyms
13480-29-0Piperazine, 1-benzyl-4-(6-methyl-1,1'-biphenyl-3-yl)-, oxalate1-Benzyl-4-(3-phenyl-4-methylphenyl)piperazine oxalate1-Benzyl-4-(6-methyl-1,1'-biphenyl-3-yl)piperazine oxalateDTXSID40158958RefChem:372552DTXCID3081449Oxalic acid--1-benzyl-4-(6-methyl[1,1'-biphenyl]-3-yl)piperazine (1/1)
Database identifiers
- CAS
13480-29-0- PubChem CID
- 202902
- DTXSID
DTXSID40158958
Properties
Computed structural properties
- Topological polar surface area
- 81.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 474
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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