Basic information
- CAS
70476-65-2- Standard SMILES
O=C1c2c(O)ccc(O)c2C(=O)c2c(NCCN3CCOCC3)ccc(NCCN3CCOCC3)c21- InChIKey
HTEVDQWBPSQOIT-UHFFFAOYSA-N- Molecular formula
- C26H32N4O6
- Average molar mass
- 496.6 g/mol
- Monoisotopic mass
- 496.23218475
Names & identifiers
- Preferred name
- 9,10-Anthracenedione, 1,4-dihydroxy-5,8-bis((2-(4-morpholinyl)ethyl)amino)-
- IUPAC
- 1,4-dihydroxy-5,8-bis(2-morpholin-4-ylethylamino)anthracene-9,10-dione
- English name
- 1,4-Dihydroxy-5,8-bis((2-(4-morpholinyl)ethyl)amino)-9,10-anthracenedi one
- Molecular weight
- 0
Names & synonyms
70476-65-29,10-Anthracenedione, 1,4-dihydroxy-5,8-bis((2-(4-morpholinyl)ethyl)amino)-1,4-Dihydroxy-5,8-bis((2-morpholinoethyl)amino)anthracene-9,10-dioneMitoxantrone Impurity 121,4-Dihydroxy-5,8-bis((2-(4-morpholinyl)ethyl)amino)-9,10-anthracenedioneCHEMBL3248537SCHEMBL10522594DTXSID602207421,4-Dihydroxy-5,8-bis{[2-(morpholin-4-yl)ethyl]amino}anthracene-9,10-dioneMitoxantrone Impurity 201,4-Dihydroxy-5,8-bis((2-(4-morpholinyl)ethyl)amino)-9,10-anthracenedi one
Database identifiers
- CAS
70476-65-2- PubChem CID
- 153155
- DTXSID
DTXSID60220742- ChEMBL
CHEMBL3248537
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 124 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 8
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 697
Chemistry & industry
Suppliers2 total
湖北瑞玛标物科技有限公司15787879035 15787875101 · [email protected]
湖北扬信医药科技有限公司15374522761 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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