1,8-Octanediamine, N,N'-bis(3-methoxy-9-acridinyl)-
Basic information
- CAS
64955-56-2- Standard SMILES
COc1ccc2c(NCCCCCCCCNc3c4ccccc4nc4cc(OC)ccc34)c3ccccc3nc2c1- InChIKey
APEGUHYDSVLTGU-UHFFFAOYSA-N- Molecular formula
- C36H38N4O2
- Average molar mass
- 558.7 g/mol
- Monoisotopic mass
- 558.29947647
Names & identifiers
- Preferred name
- 1,8-Octanediamine, N,N'-bis(3-methoxy-9-acridinyl)-
- IUPAC
- N,N'-bis(3-methoxyacridin-9-yl)octane-1,8-diamine
Names & synonyms
64955-56-21,8-Octanediamine, N,N'-bis(3-methoxy-9-acridinyl)-NSC263434CHEMBL3278758DTXSID90983515NSC 263434NSC-263434N,N'-(Octane-1,8-diyl)bis(3-methoxyacridin-9(10H)-imine)
Database identifiers
- CAS
64955-56-2- PubChem CID
- 99670
- DTXSID
DTXSID90983515- ChEMBL
CHEMBL3278758
Properties
Computed structural properties
- XLogP
- 9.3
- Topological polar surface area
- 68.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 13
- Heavy atoms
- 42
- Formal charge
- 0
- Complexity
- 734
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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