N,N'-Bis(3-chloro-9-acridinyl)-1,8-octanediamine
Basic information
- CAS
64955-63-1- Standard SMILES
Clc1ccc2c(NCCCCCCCCNc3c4ccccc4nc4cc(Cl)ccc34)c3ccccc3nc2c1- InChIKey
SGBQTMFCOOFCMU-UHFFFAOYSA-N- Molecular formula
- C34H32Cl2N4
- Average molar mass
- 567.5 g/mol
- Monoisotopic mass
- 566.2004024
Names & identifiers
- Preferred name
- N,N'-Bis(3-chloro-9-acridinyl)-1,8-octanediamine
- IUPAC
- N,N'-bis(3-chloroacridin-9-yl)octane-1,8-diamine
Names & synonyms
64955-63-1N,N'-Bis(3-chloro-9-acridinyl)-1,8-octanediamineNSC263436CHEMBL3278768DTXSID30983519NSC 263436NSC-2634361, N,N'-bis(3-chloro-9-acridinyl)-1,8-Octanediamine, N,N'-bis(3-chloro-9-acridinyl)-N,N'-(Octane-1,8-diyl)bis(3-chloroacridin-9(10H)-imine)
Database identifiers
- CAS
64955-63-1- PubChem CID
- 99672
- DTXSID
DTXSID30983519- ChEMBL
CHEMBL3278768
Properties
Computed structural properties
- XLogP
- 10.6
- Topological polar surface area
- 49.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 11
- Heavy atoms
- 40
- Formal charge
- 0
- Complexity
- 706
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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