mitoxantrone
1,4-dihydroxy-5,8-bis[2-(2-hydroxyethylamino)ethylamino]anthracene-9,10-dione
| Molecular Formula | C22H28N4O6 |
|---|---|
| Molecular Weight | 444.5 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 163.0 A2 |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 12 |
| Exact Mass | 444.2009 |
| Heavy Atoms | 32 |
| Complexity | 571.0 |
Chemical Identifiers
| CAS Number | 65271-80-9 |
|---|---|
| SMILES | C1=CC(=C2C(=C1NCCNCCO)C(=O)C3=C(C=CC(=C3C2=O)O)O)NCCNCCO |
| InChIKey | KKZJGLLVHKMTCM-UHFFFAOYSA-N |
📖 Product Overview
mitoxantrone (CAS: 65271-80-9) is a chemical compound with molecular formula C22H28N4O6 and molecular weight 444.5 g/mol. Its IUPAC systematic name is 1,4-dihydroxy-5,8-bis[2-(2-hydroxyethylamino)ethylamino]anthracene-9,10-dione.
KKZJGLLVHKMTCM-UHFFFAOYSA-N.
SMILES: C1=CC(=C2C(=C1NCCNCCO)C(=O)C3=C(C=CC(=C3C2=O)O)O)NCCNCCO.
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