Basic information
- CAS
17172-31-5- Standard SMILES
CC[N+](CC)(CCN1CCN(CC[N+](CC)(CC)Cc2ccccc2)CC1)Cc1ccccc1.[Br-].[Br-]- InChIKey
QNVXZNYUXXGODN-UHFFFAOYSA-L- Molecular formula
- C30H50Br2N4
- Average molar mass
- 626.6 g/mol
- Monoisotopic mass
- 624.24022
Names & identifiers
- Preferred name
- Ammonium, (1,4-piperazinediyldiethylene)bis(benzyldiethyl-, dibromide
- IUPAC
- benzyl-[2-[4-[2-[benzyl(diethyl)azaniumyl]ethyl]piperazin-1-yl]ethyl]-diethylazanium dibromide
Names & synonyms
Isocurine132 Lbc343 HC17172-31-5P.M. 626AMMONIUM, (1,4-PIPERAZINEDIYLDIETHYLENE)BIS(BENZYLDIETHYL-, DIBROMIDE(1,4-Piperazinediyldiethylene)bis(benzyldiethylammonium bromide)1,4-Piperazinediethanaminium, N,N,N',N'-tetraethyl-N,N'-bis(phenylmethyl)-, dibromideRefChem:3186761,4-Piperazinediethanaminium, N,N,N',N'-tetraethyl-N,N'-bis(phenylmethyl)-, dibromide (9CI)SCHEMBL29742435DTXSID90938025
Show more names
N,N'-[Piperazine-1,4-diyldi(ethane-2,1-diyl)]bis(N-benzyl-N-ethylethan-1-aminium) dibromide
Database identifiers
- CAS
17172-31-5- PubChem CID
- 28367
- DTXSID
DTXSID90938025
Properties
Computed structural properties
- Topological polar surface area
- 6.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 14
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 474
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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