Basic information
- CAS
112764-17-7- Standard SMILES
CCN(CC)CCC(=O)Nc1ccc(NC(=O)CCN(CC)CC)c2c1C(=O)c1ccccc1C2=O.Cl.Cl- InChIKey
HPXUZWFENGFOSO-UHFFFAOYSA-N- Molecular formula
- C28H38Cl2N4O4
- Average molar mass
- 565.5 g/mol
- Monoisotopic mass
- 564.2270111
Names & identifiers
- Preferred name
- Propanamide, N,N'-(9,10-dihydro-9,10-dioxo-1,4-anthracenediyl)bis(3-(diethylamino)-, dihydrochloride
- IUPAC
- 3-(diethylamino)-N-[4-[3-(diethylamino)propanoylamino]-9,10-dioxoanthracen-1-yl]propanamide;dihydrochloride
Names & synonyms
112764-17-7Propanamide, N,N'-(9,10-dihydro-9,10-dioxo-1,4-anthracenediyl)bis(3-(diethylamino)-, dihydrochlorideDTXSID00150170N,N'-(9,10-Dioxo-9,10-dihydroanthracene-1,4-diyl)bis[3-(diethylamino)propanamide]--hydrogen chloride (1/2)
Database identifiers
- CAS
112764-17-7- PubChem CID
- 188685
- DTXSID
DTXSID00150170
Properties
Computed structural properties
- Topological polar surface area
- 98.8 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 12
- Heavy atoms
- 38
- Formal charge
- 0
- Complexity
- 716
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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