Basic information
- CAS
64048-48-2- Standard SMILES
C[N+](C)(CCO)CNC(=O)c1ccc(-c2ccc(C(=O)NC[N+](C)(C)CCO)cc2)cc1.[Br-].[Br-]- InChIKey
UNBWNINLXZIZSD-UHFFFAOYSA-N- Molecular formula
- C24H36Br2N4O4
- Average molar mass
- 604.4 g/mol
- Monoisotopic mass
- 602.11033
Names & identifiers
- Preferred name
- Ammonium, (4,4'-biphenylylenebis(carbamoylmethylene))bis((2-hydroxyethyl)dimethyl-, dibromide
- IUPAC
- 2-hydroxyethyl-[[[4-[4-[[2-hydroxyethyl(dimethyl)azaniumyl]methylcarbamoyl]phenyl]benzoyl]amino]methyl]-dimethylazanium dibromide
Names & synonyms
Ammonium, (4,4'-biphenylylenebis(carbamoylmethylene))bis((2-hydroxyethyl)dimethyl-, dibromide64048-48-2RefChem:318900
Database identifiers
- CAS
64048-48-2- PubChem CID
- 46789
Properties
Computed structural properties
- Topological polar surface area
- 98.7 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 11
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 543
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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