Basic information
- CAS
109210-66-4- Standard SMILES
Cl.Cl.O=C1c2ccccc2-c2nn(CCNCCO)c3ccc(NCCNCCO)c1c23- InChIKey
NCUOEABZPSJXDI-UHFFFAOYSA-N- Molecular formula
- C22H29Cl2N5O3
- Average molar mass
- 482.4 g/mol
- Monoisotopic mass
- 481.1647452
Names & identifiers
- Preferred name
- DP 110095
- IUPAC
- 14-[2-(2-hydroxyethylamino)ethyl]-10-[2-(2-hydroxyethylamino)ethylamino]-14,15-diazatetracyclo[7.6.1.02,7.013,16]hexadeca-1(15),2,4,6,9,11,13(16)-heptaen-8-one;dihydrochloride
Names & synonyms
109210-66-4DP 110095DP-110095DTXSID40148839Anthra(1,9-cd)pyrazol-6(2H)-one, 2-(2-((2-hydroxyethyl)amino)ethyl)-5-((2-((2-hydroxyethyl)amino)ethyl)amino)-, dihydrochlorideRefChem:135738DTXCID00713302-(2-((2-Hydroxyethyl)amino)ethyl)-5-(2-((2-hydroxyethyl)aminoethyl)amino)anthra(1,9-cd)pyrazol-6(2H)one14-[2-(2-Hydroxyethylamino)ethyl]-10-[2-(2-hydroxyethylamino)ethylamino]-14,15-diazatetracyclo[7.6.1.02,7.013,16]hexadeca-1(15),2,4,6,9,11,13(16)-heptaen-8-one;dihydrochloride2-{2-[(2-Hydroxyethyl)amino]ethyl}-5-({2-[(2-hydroxyethyl)amino]ethyl}amino)dibenzo[cd,g]indazol-6(2H)-one--hydrogen chloride (1/2)
Database identifiers
- CAS
109210-66-4- PubChem CID
- 130596
- DTXSID
DTXSID40148839
Properties
Computed structural properties
- Topological polar surface area
- 111 Ų
- Hydrogen bond donors
- 7
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 11
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 565
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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