Basic information
- CAS
14585-44-5- Standard SMILES
Cc1ccc(NCC(O)CN2CCN(CC(O)CNc3ccc(C)cc3)CC2)cc1- InChIKey
CPDOMSQVNLPAJS-UHFFFAOYSA-N- Molecular formula
- C24H36N4O2
- Average molar mass
- 412.6 g/mol
- Monoisotopic mass
- 412.2838264
Names & identifiers
- Preferred name
- 1,1'-Piperazine-1,4-diylbis{3-[(4-methylphenyl)amino]propan-2-ol}
- IUPAC
- 1-[4-[2-hydroxy-3-(4-methylanilino)propyl]piperazin-1-yl]-3-(4-methylanilino)propan-2-ol
Names & synonyms
14585-44-51,1'-piperazine-1,4-diylbis{3-[(4-methylphenyl)amino]propan-2-ol}NSC153676DTXSID80302796NSC-1536761,1'-(Piperazine-1,4-diyl)bis[3-(4-methylanilino)propan-2-ol]
Database identifiers
- CAS
14585-44-5- PubChem CID
- 290372
- DTXSID
DTXSID80302796
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 71 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 10
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 414
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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