Basic information
- CAS
166895-45-0- Standard SMILES
O=C1c2ccccc2C(=O)c2c(NCCCN3CCOCC3)ccc(NCCCN3CCOCC3)c21- InChIKey
LZQHTOSKYAEQBZ-UHFFFAOYSA-N- Molecular formula
- C28H36N4O4
- Average molar mass
- 492.6 g/mol
- Monoisotopic mass
- 492.27365564
Names & identifiers
- Preferred name
- 9,10-Anthracenedione, 1,4-bis((3-(4-morpholinyl)propyl)amino)-
- IUPAC
- 1,4-bis(3-morpholin-4-ylpropylamino)anthracene-9,10-dione
Names & synonyms
166895-45-0Anthraquinone, 1,4-bis((3-morpholinopropyl)amino)-1,4-Bis((3-(4-morpholinyl)propyl)amino)-9,10-anthracenedione9,10-Anthracenedione, 1,4-bis((3-(4-morpholinyl)propyl)amino)-RefChem:3124831,4-bis{[3-(morpholin-4-yl)propyl]amino}anthracene-9,10-dioneNSC678028SCHEMBL9239646CHEMBL1995017DTXSID10937252NSC-678028NCI60_027899
Show more names
1,4-bis-[(3'-N-Morpholino)propylamino]anthraquinone
Database identifiers
- CAS
166895-45-0- PubChem CID
- 386271
- DTXSID
DTXSID10937252- ChEMBL
CHEMBL1995017
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 83.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 10
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 664
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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