Basic information
- CAS
6334-05-0- Standard SMILES
Clc1ccc(N2CCN(Cc3ccccc3)CC2)cc1- InChIKey
NBWOKGFVBQFLES-UHFFFAOYSA-N- Molecular formula
- C17H19ClN2
- Average molar mass
- 286.8 g/mol
- Monoisotopic mass
- 286.1236763
Names & identifiers
- Preferred name
- 1-Benzyl-4-(4-chlorophenyl)piperazine
- IUPAC
- 1-benzyl-4-(4-chlorophenyl)piperazine
Names & synonyms
1-benzyl-4-(4-chlorophenyl)piperazine6334-05-0CHEMBL4045701-(4-Chlorophenyl)-4-(phenylmethyl)piperazineNSC 31381NSC31381Oprea1_106753Piperazine,1-(4-chlorophenyl)-4-(phenylmethyl)-CBDivE_015098SCHEMBL588149DTXSID10283423BDBM50473575
Show more names
NSC-31381AKOS027558247AB00078084-01SR-01000473515SR-01000473515-1
Database identifiers
- CAS
6334-05-0- PubChem CID
- 233199
- DTXSID
DTXSID10283423- ChEMBL
CHEMBL404570- Nikkaji
- J1.538.219H
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 6.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 275
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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