1,4-Dihydroxy-5,8-bis((2-((2-(methylamino)ethyl)amino)ethyl)amino)-9,10-anthracenedione tetrahydrochloride
Basic information
- CAS
70476-83-4- Standard SMILES
CNCCNCCNc1ccc(NCCNCCNC)c2c1C(=O)c1c(O)ccc(O)c1C2=O.Cl.Cl.Cl.Cl- InChIKey
OBVUACVVNCTTNT-UHFFFAOYSA-N- Molecular formula
- C24H38Cl4N6O4
- Average molar mass
- 616.4 g/mol
- Monoisotopic mass
- 614.170864
Names & identifiers
- Preferred name
- 1,4-Dihydroxy-5,8-bis((2-((2-(methylamino)ethyl)amino)ethyl)amino)-9,10-anthracenedione tetrahydrochloride
- IUPAC
- 1,4-dihydroxy-5,8-bis[2-[2-(methylamino)ethylamino]ethylamino]anthracene-9,10-dione;tetrahydrochloride
Names & synonyms
1,4-Dihydroxy-5,8-bis((2-((2-(methylamino)ethyl)amino)ethyl)amino)-9,10-anthracenedione tetrahydrochloride70476-83-49,10-Anthracenedione, 1,4-dihydroxy-5,8-bis((2-((2-(methylamino)ethyl)amino)ethyl)amino)-, tetrahydrochlorideSCHEMBL10524280DTXSID002207461,4-Dihydroxy-5,8-bis[(2-{[2-(methylamino)ethyl]amino}ethyl)amino]anthracene-9,10-dione--hydrogen chloride (1/4)
Database identifiers
- CAS
70476-83-4- PubChem CID
- 135474
- DTXSID
DTXSID00220746
Properties
Computed structural properties
- Topological polar surface area
- 147 Ų
- Hydrogen bond donors
- 12
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 14
- Heavy atoms
- 38
- Formal charge
- 0
- Complexity
- 599
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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