2-Anthraceneacetamide, N-(2-(diethylamino)ethyl)-9,10-dihydro-1,4-dihydroxy-9,10-dioxo-, monohydrochloride
Basic information
- CAS
81085-94-1- Standard SMILES
CCN(CC)CCNC(=O)Cc1cc(O)c2c(c1O)C(=O)c1ccccc1C2=O.Cl- InChIKey
NLAWGUKLBNSREV-UHFFFAOYSA-N- Molecular formula
- C22H25ClN2O5
- Average molar mass
- 432.9 g/mol
- Monoisotopic mass
- 432.1451996
Names & identifiers
- Preferred name
- 2-Anthraceneacetamide, N-(2-(diethylamino)ethyl)-9,10-dihydro-1,4-dihydroxy-9,10-dioxo-, monohydrochloride
- IUPAC
- N-[2-(diethylamino)ethyl]-2-(1,4-dihydroxy-9,10-dioxoanthracen-2-yl)acetamide;hydrochloride
Names & synonyms
81085-94-12-Anthraceneacetamide, N-(2-(diethylamino)ethyl)-9,10-dihydro-1,4-dihydroxy-9,10-dioxo-, monohydrochlorideCHEMBL563738DTXSID30230878NSC328803NSC 328803NSC-328803N-(2-(Diethylamino)ethyl)-9,10-dihydro-1,4-dihydroxy-9,10-dioxo-2-anthraceneacetamide monohydrochlorideDS-001808N-(2-diethylaminoethyl)-2-(1,4-dihydroxy-9,10-dioxo-anthracen-2-yl)acetamideN-[2-(Diethylamino)ethyl]-2-(1,4-dihydroxy-9,10-dioxo-9,10-dihydroanthracen-2-yl)acetamide--hydrogen chloride (1/1)
Database identifiers
- CAS
81085-94-1- PubChem CID
- 157356
- DTXSID
DTXSID30230878- ChEMBL
CHEMBL563738
Properties
Computed structural properties
- Topological polar surface area
- 107 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 620
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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