Basic information
- CAS
7256-23-7- Standard SMILES
CCCCNC(C)C(O)c1ccc(-c2ccc(C(O)C(C)NCCCC)cc2)cc1- InChIKey
HLQCZIGONWBKKO-UHFFFAOYSA-N- Molecular formula
- C26H40N2O2
- Average molar mass
- 412.6 g/mol
- Monoisotopic mass
- 412.30897852
Names & identifiers
- Preferred name
- 1,1'-Biphenyl-4,4'-diylbis[2-(butylamino)propan-1-ol]
- IUPAC
- 2-(butylamino)-1-[4-[4-[2-(butylamino)-1-hydroxypropyl]phenyl]phenyl]propan-1-ol
Names & synonyms
7256-23-71,1'-biphenyl-4,4'-diylbis[2-(butylamino)propan-1-ol]NSC23930DTXSID90282035NSC-239301,1'-([1,1'-Biphenyl]-4,4'-diyl)bis[2-(butylamino)propan-1-ol]
Database identifiers
- CAS
7256-23-7- PubChem CID
- 229873
- DTXSID
DTXSID90282035
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 64.5 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 13
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 391
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…