N,N'-bis(6-chloro-2-methoxyacridin-9-yl)octane-1,8-diamine
Basic information
- CAS
67047-12-5- Standard SMILES
COc1ccc2nc3cc(Cl)ccc3c(NCCCCCCCCNc3c4ccc(Cl)cc4nc4ccc(OC)cc34)c2c1- InChIKey
PJKQWFZYJDFYFP-UHFFFAOYSA-N- Molecular formula
- C36H36Cl2N4O2
- Average molar mass
- 627.6 g/mol
- Monoisotopic mass
- 626.2215318
Names & identifiers
- Preferred name
- N,N'-bis(6-chloro-2-methoxyacridin-9-yl)octane-1,8-diamine
- IUPAC
- N,N'-bis(6-chloro-2-methoxyacridin-9-yl)octane-1,8-diamine
Names & synonyms
NSC276377CHEMBL328742NSC-276377
Database identifiers
- CAS
67047-12-5- PubChem CID
- 321882
- ChEMBL
CHEMBL328742- Nikkaji
- J1.381.045A
Properties
Computed structural properties
- XLogP
- 10.5
- Topological polar surface area
- 68.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 13
- Heavy atoms
- 44
- Formal charge
- 0
- Complexity
- 802
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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